Back to Search
1-(1-Cyclopenten-1-Yl)Pyrrolidine
CAS: 7148-07-4 | C9H15N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7148-07-4
Molecular Formula:
C9H15N
Molecular Weight:
137.226 g/mol
Names and Synonyms:
1-(1-Cyclopenten-1-Yl)Pyrrolidine
Pyrrolidine, 1-(1-cyclopenten-1-yl)-
1-(1-Cyclopenten-1-yl)pyrrolidine
1-Pyrrolidinocyclopentene
1-(Cyclopent-1′-enyl)pyrrolidine
1-Cyclopentenylpyrrolidine
1-(1-Pyrrolidinyl)-1-cyclopentene
1-(1-Pyrrolidinyl)cyclopentene
N-(1-Cyclopenten-1-yl)pyrrolidine
1-(1-Cyclopentenyl)pyrrolidine
Cyclopentanone pyrrolidine enamine
1-Pyrrolidinylcyclopentene
N-(1-Cyclopentenyl)pyrrolidine
NSC 29653
Identifiers:
SMILES:
C1=C(N2CCCC2)CCC1
InChI:
InChI=1S/C9H15N/c1-2-6-9(5-1)10-7-3-4-8-10/h5H,1-4,6-8H2
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.
All Properties
Comprehensive physical and chemical properties
Physical Properties
Property | Value | Source |
---|---|---|
molecular_mass | 137.23 g/mol | Legacy Database |
cas-boiling-point | 101-102 °C @ Press: 22 Torr None | Legacy Database |
cas-canonical-smile | C1=C(N2CCCC2)CCC1 None | Legacy Database |
cas-inchi | InChI=1S/C9H15N/c1-2-6-9(5-1)10-7-3-4-8-10/h5H,1-4,6-8H2 None | Legacy Database |
cas-inchi-key | InChIKey=KOFSFYBXUYHNJL-UHFFFAOYSA-N None | Legacy Database |
cas-name | 1-(1-Cyclopenten-1-yl)pyrrolidine None | Legacy Database |
LogP | 2.1500000000000004 | RDKit |
Molecular
Property | Value | Source |
---|---|---|
Molecular Weight | 137.226 g/mol | RDKit |
Exact
Property | Value | Source |
---|---|---|
Exact Molecular Weight | 137.12044948 g/mol | RDKit |
Heavy
Property | Value | Source |
---|---|---|
Heavy Atom Count | 10 count | RDKit |
Hydrogen
Property | Value | Source |
---|---|---|
Hydrogen Bond Acceptors | 1 count | RDKit |
Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
Property | Value | Source |
---|---|---|
Rotatable Bonds | 1 count | RDKit |
Aromatic
Property | Value | Source |
---|---|---|
Aromatic Ring Count | 0 count | RDKit |
Topological
Property | Value | Source |
---|---|---|
Topological Polar Surface Area | 3.24 Ų | RDKit |
Molar
Property | Value | Source |
---|---|---|
Molar Refractivity | 42.74100000000002 | RDKit |