N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine

C18H34N2 — CID 79544436

IUPACN-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
SMILESCCC(NC1CCCC1C1CCCN1)C1CCCCC1
InChIInChI=1S/C18H34N2/c1-2-16(14-8-4-3-5-9-14)20-18-11-6-10-15(18)17-12-7-13-19-17/h14-20H,2-13H2,1H3
InChIKeyOICGELZWJDRQCM-UHFFFAOYSA-N
MW278.48 g/mol
LogP3.86
Rot. Bonds5

About N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine

N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine (PubChem CID 79544436) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
PubChem CID79544436
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC NameN-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
SMILESCCC(NC1CCCC1C1CCCN1)C1CCCCC1
InChIInChI=1S/C18H34N2/c1-2-16(14-8-4-3-5-9-14)20-18-11-6-10-15(18)17-12-7-13-19-17/h14-20H,2-13H2,1H3
InChIKeyOICGELZWJDRQCM-UHFFFAOYSA-N
XLogP3.86
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 81384136
2-[(2-pyrrolidin-2-ylcyclohexyl)amino]butan-1-ol
CID 79545851
N-hexan-3-yl-2-piperidin-2-ylcyclohexan-1-amine
CID 79553740
3-[(2-piperidin-2-ylcyclopentyl)amino]pentan-1-ol
CID 113495583
N-pent-1-yn-3-yl-2-piperidin-2-ylcyclohexan-1-amine
CID 106224436
N-(2-methylcyclopropyl)-2-piperidin-2-ylcyclopentan-1-amine
CID 79544805
(2S)-3-methyl-2-[(2-piperidin-2-ylcyclopentyl)amino]butan-1-ol
CID 79544884
1-N,1-N-dimethyl-2-N-(2-piperidin-2-ylcyclopentyl)propane-1,2-diamine
CID 82939086
N-ethyl-2-piperidin-2-ylcyclohexan-1-amine
CID 79553478
N-(2-methylpropyl)-2-piperidin-2-ylcyclopentan-1-amine
CID 79544832
N-(2-methylpropoxy)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 82711540
N-octan-4-yl-2-piperidin-2-ylcyclohexan-1-amine
CID 106023087

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine (CID 79544436) is N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine is CCC(NC1CCCC1C1CCCN1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine?
The InChIKey is OICGELZWJDRQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-2-16(14-8-4-3-5-9-14)20-18-11-6-10-15(18)17-12-7-13-19-17/h14-20H,2-13H2,1H3.
What are the key properties of N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine?
N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine has a molecular weight of 278.48 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpropyl)-2-pyrrolidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 79544436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).