[2-(azepan-1-yl)cyclopentyl]methanamine

C12H24N2 — CID 43293383

IUPAC[2-(azepan-1-yl)cyclopentyl]methanamine
SMILESNCC1CCCC1N1CCCCCC1
InChIInChI=1S/C12H24N2/c13-10-11-6-5-7-12(11)14-8-3-1-2-4-9-14/h11-12H,1-10,13H2
InChIKeyRWUMBHZHUVZNSV-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.99
Rot. Bonds2

About [2-(azepan-1-yl)cyclopentyl]methanamine

[2-(azepan-1-yl)cyclopentyl]methanamine (PubChem CID 43293383) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is [2-(azepan-1-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-(azepan-1-yl)cyclopentyl]methanamine
PubChem CID43293383
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name[2-(azepan-1-yl)cyclopentyl]methanamine
SMILESNCC1CCCC1N1CCCCCC1
InChIInChI=1S/C12H24N2/c13-10-11-6-5-7-12(11)14-8-3-1-2-4-9-14/h11-12H,1-10,13H2
InChIKeyRWUMBHZHUVZNSV-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethanamine;dihydrochloride
CID 50944349
[(9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanamine;hydrochloride
CID 119056746
[(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanamine
CID 129361363
[2-(3-piperidin-1-ylpyrrolidin-1-yl)cyclopentyl]methanamine
CID 55158006
[2-(4-methylpiperidin-1-yl)cyclopentyl]methanamine
CID 43293313
[2-(4-methyl-1,4-diazepan-1-yl)cyclopentyl]methanamine
CID 43293580
[2-(azepan-1-yl)cyclopentyl]methanol
CID 106364698
[2-(4-phenylpiperazin-1-yl)cyclopentyl]methanamine
CID 43293527
[2-[3-(methoxymethyl)piperidin-1-yl]cyclopentyl]methanamine
CID 106586143
[2-(3-methylazetidin-1-yl)cycloheptyl]methanamine
CID 164661715
[2-(3,3-difluoropyrrolidin-1-yl)cyclopentyl]methanamine
CID 130646471
(4-ethyl-2-piperidin-1-ylcyclohexyl)methanamine
CID 43293406

Frequently Asked Questions

What is the IUPAC name of [2-(azepan-1-yl)cyclopentyl]methanamine?
The IUPAC name of [2-(azepan-1-yl)cyclopentyl]methanamine (CID 43293383) is [2-(azepan-1-yl)cyclopentyl]methanamine.
What is the SMILES notation for [2-(azepan-1-yl)cyclopentyl]methanamine?
The canonical SMILES for [2-(azepan-1-yl)cyclopentyl]methanamine is NCC1CCCC1N1CCCCCC1.
What is the InChIKey of [2-(azepan-1-yl)cyclopentyl]methanamine?
The InChIKey is RWUMBHZHUVZNSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c13-10-11-6-5-7-12(11)14-8-3-1-2-4-9-14/h11-12H,1-10,13H2.
What are the key properties of [2-(azepan-1-yl)cyclopentyl]methanamine?
[2-(azepan-1-yl)cyclopentyl]methanamine has a molecular weight of 196.34 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(azepan-1-yl)cyclopentyl]methanamine is sourced from PubChem (CID 43293383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).