1-(3-Hydroxypropyl)pyrrolidin-2-one

C₇H₁₃NO₂CAS 62012-15-1143.19 g/mol

Open in Covalent MOL file

Alcohol Amide Lactam

Properties

Molecular formula: C₇H₁₃NO₂
Molar mass: 143.19 g/mol
Exact mass: 143.0946 Da
Boiling point: 138–140 °C (at 1 Torr)
logP: -0.01Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Hazards

Warning

H319 Causes serious eye irritation100% of notifiers

Aggregated from 38 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number

62012-15-1

SMILES

O=C1CCCN1CCCO

InChIKey

CVDGNRZPDAXOQO-UHFFFAOYSA-N

InChI

InChI=1S/C7H13NO2/c9-6-2-5-8-4-1-3-7(8)10/h9H,1-6H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names

1-(3-Hydroxypropyl)-2-pyrrolidinone
2-Pyrrolidinone, 1-(3-hydroxypropyl)-
1-(3-Hydroxypropyl)-2-pyrrolidone
1-(3-Hydroxy-1-propyl)-2-pyrrolidone
1-(3-Hydroxypropyl)-2-pyrrolidineone
3-(2-Oxopyrrolidin-1-yl)propanol

Work with 1-(3-Hydroxypropyl)pyrrolidin-2-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-(2-Hydroxyethyl)-2-pyrrolidinone3445-11-283 % similar N1,N1,N6,N6-Tetrakis(2-hydroxyethyl)hexanediamide6334-25-472 % similar N-(Hydroxymethyl)-2-pyrrolidone15438-71-865 % similar N-Butyl-2-pyrrolidone3470-98-257 % similar 1-(3-Aminopropyl)-2-pyrrolidinone7663-77-657 % similar Lauric acid diethanolamide120-40-156 % similar N-Ethyl-2-pyrrolidone2687-91-454 % similar N-Octylpyrrolidone2687-94-753 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl (2E)-3-(dimethylamino)-2-propenoate1117-37-9 Isopropyl β-aminocrotonate14205-46-0 2,2-Diethoxy-1-isocyanoethane15586-32-0 Methyl (3R)-3-piperidinecarboxylate164323-85-7 1,4-Dioxa-8-azaspiro(4.5)decane177-11-7 4-Aminocyclohexanecarboxylic acid1776-53-0 3,3-Diethoxypropiononitrile2032-34-0 N-(2-Hydroxypropyl)methacrylamide21442-01-3

Elsewhere

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