2-(1-phenylcyclopentyl)ethanamine;hydrochloride

C13H20ClN — CID 155970926

IUPAC2-(1-phenylcyclopentyl)ethanamine;hydrochloride
SMILESCl.NCCC1(c2ccccc2)CCCC1
InChIInChI=1S/C13H19N.ClH/c14-11-10-13(8-4-5-9-13)12-6-2-1-3-7-12;/h1-3,6-7H,4-5,8-11,14H2;1H
InChIKeyNOQCZFLWLKQRLI-UHFFFAOYSA-N
MW225.76 g/mol
LogP3.27
Rot. Bonds3

About 2-(1-phenylcyclopentyl)ethanamine;hydrochloride

2-(1-phenylcyclopentyl)ethanamine;hydrochloride (PubChem CID 155970926) has the molecular formula C13H20ClN and a molecular weight of 225.76 g/mol. Its IUPAC name is 2-(1-phenylcyclopentyl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(1-phenylcyclopentyl)ethanamine;hydrochloride
PubChem CID155970926
Molecular FormulaC13H20ClN
Molecular Weight225.76 g/mol
Exact Mass225.13
IUPAC Name2-(1-phenylcyclopentyl)ethanamine;hydrochloride
SMILESCl.NCCC1(c2ccccc2)CCCC1
InChIInChI=1S/C13H19N.ClH/c14-11-10-13(8-4-5-9-13)12-6-2-1-3-7-12;/h1-3,6-7H,4-5,8-11,14H2;1H
InChIKeyNOQCZFLWLKQRLI-UHFFFAOYSA-N
XLogP3.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.76
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-phenyloxan-3-yl)ethanamine
CID 83819944
2-[1-(4-methylphenyl)cyclohexyl]ethanamine
CID 82079127
2-(1-pyridin-3-ylcyclohexyl)ethanamine
CID 83819763
4-[1-(4-phenylphenyl)cyclobutyl]butan-1-amine;hydrochloride
CID 69400003
[1-(iodomethyl)cyclopentyl]benzene
CID 19966123
2-[1-(2-fluorophenyl)cyclohexyl]ethanamine
CID 82080099
(1-butylcyclobutyl)benzene
CID 57200184
2-[1-(3,5-difluorophenyl)cyclopentyl]ethanamine
CID 83823340
2-(1-pyridin-2-ylcycloheptyl)ethanamine
CID 83821963
2-[1-(2-methylphenyl)cyclohexyl]ethanamine
CID 82079125
3-(1-phenylcyclobutyl)propanoic acid
CID 91807231
N,N-dimethyl-1-(1-phenylcyclopentyl)methanamine
CID 646439

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenylcyclopentyl)ethanamine;hydrochloride?
The IUPAC name of 2-(1-phenylcyclopentyl)ethanamine;hydrochloride (CID 155970926) is 2-(1-phenylcyclopentyl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(1-phenylcyclopentyl)ethanamine;hydrochloride?
The canonical SMILES for 2-(1-phenylcyclopentyl)ethanamine;hydrochloride is Cl.NCCC1(c2ccccc2)CCCC1.
What is the InChIKey of 2-(1-phenylcyclopentyl)ethanamine;hydrochloride?
The InChIKey is NOQCZFLWLKQRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N.ClH/c14-11-10-13(8-4-5-9-13)12-6-2-1-3-7-12;/h1-3,6-7H,4-5,8-11,14H2;1H.
What are the key properties of 2-(1-phenylcyclopentyl)ethanamine;hydrochloride?
2-(1-phenylcyclopentyl)ethanamine;hydrochloride has a molecular weight of 225.76 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenylcyclopentyl)ethanamine;hydrochloride is sourced from PubChem (CID 155970926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).