1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine

C12H22N2 — CID 106172458

IUPAC1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(CCC2=CCCC2)C1
InChIInChI=1S/C12H22N2/c1-13-12-7-9-14(10-12)8-6-11-4-2-3-5-11/h4,12-13H,2-3,5-10H2,1H3
InChIKeyDVYMQVCTDHYCKU-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.78
Rot. Bonds4

About 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine

1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine (PubChem CID 106172458) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine
PubChem CID106172458
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(CCC2=CCCC2)C1
InChIInChI=1S/C12H22N2/c1-13-12-7-9-14(10-12)8-6-11-4-2-3-5-11/h4,12-13H,2-3,5-10H2,1H3
InChIKeyDVYMQVCTDHYCKU-UHFFFAOYSA-N
XLogP1.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(cyclohexen-1-ylmethyl)-N-methylpyrrolidin-3-amine
CID 130964315
1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine
CID 106172504
N-[2-(cyclopenten-1-yl)ethyl]-1-methylpiperidin-3-amine
CID 106169620
2-[2-(cyclohexen-1-yl)ethyl]-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
CID 107854223
ethane;N-methyl-1-(3-methylbutyl)pyrrolidin-3-amine
CID 166168128
1-[2-(cyclohexen-1-yl)ethyl]-3,5-dimethylpiperazine
CID 82287017
1-[2-(cyclohexen-1-yl)ethyl]piperidine-4-carboxylic acid
CID 82476753
(3R)-N-methyl-1-(3-phenylpropyl)pyrrolidin-3-amine
CID 142940640
N-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidin-3-amine
CID 63242038
4-[2-(cyclohexen-1-yl)ethyl]-N-cyclohexylpiperazine-1-carboxamide
CID 113073163
(3R)-1-[3-(4-chlorophenyl)propyl]-N-methylpyrrolidin-3-amine
CID 58688933
1-[2-(cyclohexen-1-yl)ethyl]pyrrolidine;trifluoroborane
CID 10944742

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine?
The IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine (CID 106172458) is 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine?
The canonical SMILES for 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine is CNC1CCN(CCC2=CCCC2)C1.
What is the InChIKey of 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine?
The InChIKey is DVYMQVCTDHYCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-13-12-7-9-14(10-12)8-6-11-4-2-3-5-11/h4,12-13H,2-3,5-10H2,1H3.
What are the key properties of 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine?
1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine has a molecular weight of 194.32 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopenten-1-yl)ethyl]-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 106172458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).