1-[1-(4-chlorophenyl)cyclopentyl]ethanamine

C13H18ClN — CID 83691849

IUPAC1-[1-(4-chlorophenyl)cyclopentyl]ethanamine
SMILESCC(N)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C13H18ClN/c1-10(15)13(8-2-3-9-13)11-4-6-12(14)7-5-11/h4-7,10H,2-3,8-9,15H2,1H3
InChIKeyVHRKNUUSGMJKIT-UHFFFAOYSA-N
MW223.75 g/mol
LogP3.50
Rot. Bonds2

About 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine

1-[1-(4-chlorophenyl)cyclopentyl]ethanamine (PubChem CID 83691849) has the molecular formula C13H18ClN and a molecular weight of 223.75 g/mol. Its IUPAC name is 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine.

Molecular Properties

Compound Name1-[1-(4-chlorophenyl)cyclopentyl]ethanamine
PubChem CID83691849
Molecular FormulaC13H18ClN
Molecular Weight223.75 g/mol
Exact Mass223.11
IUPAC Name1-[1-(4-chlorophenyl)cyclopentyl]ethanamine
SMILESCC(N)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C13H18ClN/c1-10(15)13(8-2-3-9-13)11-4-6-12(14)7-5-11/h4-7,10H,2-3,8-9,15H2,1H3
InChIKeyVHRKNUUSGMJKIT-UHFFFAOYSA-N
XLogP3.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.75
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

acetylene;1-[1-(4-chlorophenyl)cyclobutyl]ethanamine;propane
CID 91613724
1-[1-(4-iodophenyl)cyclopentyl]ethanamine
CID 117047031
1-(1-phenylcyclopentyl)ethanamine;hydrochloride
CID 75466877
(1R)-1-(1-phenylcyclohexyl)ethanamine
CID 78998571
1-[1-(4-cyclopropylphenyl)cyclopentyl]ethanamine
CID 117047052
(1S,2S)-1-amino-1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-2-ol;hydrochloride
CID 139996809
2-[1-(4-chlorophenyl)cyclopentyl]propanoic acid
CID 68974773
1-chloro-4-[1-(difluoromethyl)cyclohexyl]benzene
CID 84728475
(1R,3S)-1-[1-(4-chlorophenyl)cyclobutyl]-3-methylpentan-1-amine
CID 59908351
1-[1-(4-chloro-3-fluorophenyl)cyclopropyl]ethanamine
CID 83689421
1-[1-(4-chlorophenyl)cyclobutyl]butan-1-amine
CID 13083249
1-[1-(4-methylsulfanylphenyl)cyclopropyl]ethanamine
CID 83702166

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine?
The IUPAC name of 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine (CID 83691849) is 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine.
What is the SMILES notation for 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine?
The canonical SMILES for 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine is CC(N)C1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine?
The InChIKey is VHRKNUUSGMJKIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN/c1-10(15)13(8-2-3-9-13)11-4-6-12(14)7-5-11/h4-7,10H,2-3,8-9,15H2,1H3.
What are the key properties of 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine?
1-[1-(4-chlorophenyl)cyclopentyl]ethanamine has a molecular weight of 223.75 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-chlorophenyl)cyclopentyl]ethanamine is sourced from PubChem (CID 83691849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).