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Atenolol

CAS: 29122-68-7 | C14H22N2O3

2D Structure

3D Structure

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Basic Information

CAS Registry Number: 29122-68-7

Molecular Formula: C14H22N2O3

Molecular Weight: 266.341 g/mol

Names and Synonyms:

Atenolol Common Name

2-[4-[2-Hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide Synonym

2-(4-(2-Hydroxy-3-(isopropylamino)propoxy)phenyl)acetamide Synonym

2-[4-(2-Hydroxy-3-isopropylamino-propoxy)-phenyl]-acetamide Synonym

2-(4-[2-Hydroxy-3-[(propan-2-yl)amino]propoxy]phenyl)acetamide Synonym

RS-alprenolol Synonym

(R,S)-Atenolol Synonym

Juvental Synonym

Catenolol Synonym

Novaten Synonym

Ateno Synonym

Tenordin Synonym

Telol Synonym

Aten Synonym

Ternomin Synonym

Uniloc Synonym

Ibinolo Synonym

Selobloc Synonym

Prenormine Synonym

Teno-basan Synonym

Seles Beta Synonym

Cuxanorm Synonym

Hypoten Synonym

Felo-Bits Synonym

Xaten Synonym

Wesipin Synonym

Vericordin Synonym

Vascoten Synonym

Urosin Synonym

Tredol Synonym

Tensimin Synonym

Tensig Synonym

Tenoprin Synonym

Tenolol Synonym

Tenolin Synonym

Tenoblock Synonym

Tenidon Synonym

Stermin Synonym

Serten Synonym

Seles Synonym

Prenolol Synonym

Premorine Synonym

Oraday Synonym

Noten Synonym

Normiten Synonym

Normalol Synonym

Myocord Synonym

Lotenal Synonym

Lo-ten Synonym

Internolol Synonym

Hipres Synonym

Atenil Synonym

Ateni Synonym

Farnormin Synonym

Evitocor Synonym

Corotenol Synonym

Coratol Synonym

Catenol Synonym

B-Vasc Synonym

Blokium Synonym

Betacard Synonym

Betablok Synonym

Atolmin Synonym

Aterol Synonym

Atereal Synonym

Atenol Synonym

Atecard Synonym

Atcardil Synonym

Atenet Synonym

Atendol Synonym

Atenblock Synonym

Atelol Synonym

AteHexal Synonym

Antipressan Synonym

Anselol Synonym

Apo-Atenolol Synonym

Alinor Synonym

Altol Synonym

(RS)-Atenolol Synonym

dl-Atenolol Synonym

DL-Atenolol Synonym

(±)-Atenolol Synonym

Duraatenolol Synonym

Tenormin Synonym

Atenolol Synonym

ICI 66082 Synonym

Tenormine Synonym

4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]benzeneacetamide Synonym

Acetamide, 2-[p-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]- Synonym

Benzeneacetamide, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]- Synonym

Identifiers:

SMILES:

CC(C)NCC(O)COc1ccc(CC(=N)O)cc1

InChI:

InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)

Spectral Data

NMR, IR, and Mass spectral data

1H NMR

13C NMR

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

PubChem CAS NIST

All Properties

Comprehensive physical and chemical properties

Molecular

Property	Value	Source
Molecular Weight	266.341 g/mol	RDKit

Exact

Property	Value	Source
Exact Molecular Weight	266.163042564 g/mol	RDKit

Heavy

Property	Value	Source
Heavy Atom Count	19 count	RDKit

Hydrogen

Property	Value	Source
Hydrogen Bond Acceptors	4 count	RDKit
Hydrogen Bond Donors	4 count	RDKit

Rotatable

Property	Value	Source
Rotatable Bonds	8 count	RDKit

Aromatic

Property	Value	Source
Aromatic Ring Count	1 count	RDKit

Topological

Property	Value	Source
Topological Polar Surface Area	85.57000000000001 Å²	RDKit

Physical Properties

Property	Value	Source
LogP	1.5020699999999996	RDKit
molecular_mass	266.34 g/mol	Legacy Database
cas-canonical-smile	O=C(N)CC1=CC=C(OCC(O)CNC(C)C)C=C1 None	Legacy Database
cas-inchi	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18) None	Legacy Database
cas-inchi-key	InChIKey=METKIMKYRPQLGS-UHFFFAOYSA-N None	Legacy Database
cas-melting-point	146-148 °C None	Legacy Database
cas-name	Atenolol None	Legacy Database

Molar

Property	Value	Source
Molar Refractivity	75.14200000000004	RDKit