[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine

C12H24N2 — CID 62632841

IUPAC[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine
SMILESCC(C1CCCC1)N1CCC(CN)C1
InChIInChI=1S/C12H24N2/c1-10(12-4-2-3-5-12)14-7-6-11(8-13)9-14/h10-12H,2-9,13H2,1H3
InChIKeyXYULSIRPMVZEGW-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.85
Rot. Bonds3

About [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine

[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine (PubChem CID 62632841) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine
PubChem CID62632841
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine
SMILESCC(C1CCCC1)N1CCC(CN)C1
InChIInChI=1S/C12H24N2/c1-10(12-4-2-3-5-12)14-7-6-11(8-13)9-14/h10-12H,2-9,13H2,1H3
InChIKeyXYULSIRPMVZEGW-UHFFFAOYSA-N
XLogP1.85
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(1-cyclopropylpropyl)pyrrolidin-3-yl]methanamine
CID 64918269
2-[3-(aminomethyl)pyrrolidin-1-yl]-N,N-dimethylpropan-1-amine
CID 115492059
[1-[1-(2-methylcyclopropyl)ethyl]piperidin-3-yl]methanamine
CID 130689917
1-(1-cyclohexylethyl)-3-ethylpiperidin-4-amine
CID 81457020
1-[1-(1-cyclohexylethyl)piperidin-4-yl]ethanamine
CID 63596713
[1-[1-(oxan-4-yl)ethyl]pyrrolidin-3-yl]methanol
CID 105400777
[(3R)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]methanamine
CID 2237132
1-(1-cyclopentylethyl)pyrrolidine-3-carboxylic acid
CID 65066559
(1,2-dimethyldiazinan-4-yl)methanamine
CID 84648894
3-[1-(1-cyclohexylethyl)piperidin-4-yl]propanoic acid
CID 65062735
3-[3-(aminomethyl)pyrrolidin-1-yl]-4-methylpentanoic acid
CID 112709333
1-(1-cyclobutyl-2-methylpropyl)pyrrolidin-3-amine
CID 130639012

Frequently Asked Questions

What is the IUPAC name of [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine (CID 62632841) is [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine is CC(C1CCCC1)N1CCC(CN)C1.
What is the InChIKey of [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine?
The InChIKey is XYULSIRPMVZEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10(12-4-2-3-5-12)14-7-6-11(8-13)9-14/h10-12H,2-9,13H2,1H3.
What are the key properties of [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine?
[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine has a molecular weight of 196.34 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 62632841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).