N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine

C19H29N — CID 64909961

IUPACN-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine
SMILESCC1CCC(NC2CCCCC2c2ccccc2)C1C
InChIInChI=1S/C19H29N/c1-14-12-13-18(15(14)2)20-19-11-7-6-10-17(19)16-8-4-3-5-9-16/h3-5,8-9,14-15,17-20H,6-7,10-13H2,1-2H3
InChIKeyUUPXXUHFKCWTPF-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.74
Rot. Bonds3

About N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine

N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine (PubChem CID 64909961) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine
PubChem CID64909961
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC NameN-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine
SMILESCC1CCC(NC2CCCCC2c2ccccc2)C1C
InChIInChI=1S/C19H29N/c1-14-12-13-18(15(14)2)20-19-11-7-6-10-17(19)16-8-4-3-5-9-16/h3-5,8-9,14-15,17-20H,6-7,10-13H2,1-2H3
InChIKeyUUPXXUHFKCWTPF-UHFFFAOYSA-N
XLogP4.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-N-(2-phenylcyclohexyl)cyclohexan-1-amine
CID 43784317
N-(2,3-dimethylcyclopentyl)-4-phenylcyclohexan-1-amine
CID 64908026
N-(2,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine
CID 64909530
trans-(1R,2S)-N-tert-butyl-2-phenylcyclohexan-1-amine
CID 159407891
(2-methylcyclopentyl)benzene
CID 12600454
2-phenyl-N-propylcyclohexan-1-amine
CID 43755016
N-(2-phenylcyclohexyl)oxolan-3-amine
CID 80716893
[(1S,2S)-2-methylcyclobutyl]benzene
CID 5314354
N-(3-ethylcyclohexyl)-2-phenylcyclohexan-1-amine
CID 64743368
N-(2,2-dimethylpropyl)-2-phenylcyclohexan-1-amine
CID 61166824
carbon dioxide;[(1S,2S)-2-methylcyclohexyl]benzene
CID 123742009
3,5-difluoro-N-(2-phenylcyclohexyl)aniline
CID 43765027

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine?
The IUPAC name of N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine (CID 64909961) is N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine.
What is the SMILES notation for N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine?
The canonical SMILES for N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine is CC1CCC(NC2CCCCC2c2ccccc2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine?
The InChIKey is UUPXXUHFKCWTPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-14-12-13-18(15(14)2)20-19-11-7-6-10-17(19)16-8-4-3-5-9-16/h3-5,8-9,14-15,17-20H,6-7,10-13H2,1-2H3.
What are the key properties of N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine?
N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine has a molecular weight of 271.45 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclopentyl)-2-phenylcyclohexan-1-amine is sourced from PubChem (CID 64909961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).