4-(3-cyclopentylphenyl)butan-1-amine

C15H23N — CID 117310057

IUPAC4-(3-cyclopentylphenyl)butan-1-amine
SMILESNCCCCc1cccc(C2CCCC2)c1
InChIInChI=1S/C15H23N/c16-11-4-3-6-13-7-5-10-15(12-13)14-8-1-2-9-14/h5,7,10,12,14H,1-4,6,8-9,11,16H2
InChIKeyFKJDGXJZRXIVJP-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.63
Rot. Bonds5

About 4-(3-cyclopentylphenyl)butan-1-amine

4-(3-cyclopentylphenyl)butan-1-amine (PubChem CID 117310057) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 4-(3-cyclopentylphenyl)butan-1-amine.

Molecular Properties

Compound Name4-(3-cyclopentylphenyl)butan-1-amine
PubChem CID117310057
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name4-(3-cyclopentylphenyl)butan-1-amine
SMILESNCCCCc1cccc(C2CCCC2)c1
InChIInChI=1S/C15H23N/c16-11-4-3-6-13-7-5-10-15(12-13)14-8-1-2-9-14/h5,7,10,12,14H,1-4,6,8-9,11,16H2
InChIKeyFKJDGXJZRXIVJP-UHFFFAOYSA-N
XLogP3.63
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(3-cyclopentylphenyl)butan-1-amine 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

4-[3-(4-methylcyclohexyl)phenyl]butan-1-amine
CID 117366404
2-(3-cyclobutylphenyl)ethanamine
CID 83827556
2-(3-cyclopropylphenyl)ethanamine
CID 79983898
4-(4-cyclopentylphenyl)butan-1-amine
CID 117310056
3-[3-(1-methylpiperidin-4-yl)phenyl]propan-1-amine
CID 117337018
4-(3-cyclopentylphenyl)butanoic acid
CID 117336755
(3-cycloheptylphenyl)methanol
CID 84672634
N'-[(3-cyclopropylphenyl)methyl]butane-1,4-diamine
CID 79979439
3-(3-cycloheptylphenyl)propanal
CID 117332990
3-(3-cyclopentylphenyl)propanoic acid
CID 83836630
N'-[(3-cyclopropylphenyl)methyl]propane-1,3-diamine
CID 79979365
(3-cyclohexylphenyl)methanethiol
CID 22000684

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylphenyl)butan-1-amine?
The IUPAC name of 4-(3-cyclopentylphenyl)butan-1-amine (CID 117310057) is 4-(3-cyclopentylphenyl)butan-1-amine.
What is the SMILES notation for 4-(3-cyclopentylphenyl)butan-1-amine?
The canonical SMILES for 4-(3-cyclopentylphenyl)butan-1-amine is NCCCCc1cccc(C2CCCC2)c1.
What is the InChIKey of 4-(3-cyclopentylphenyl)butan-1-amine?
The InChIKey is FKJDGXJZRXIVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c16-11-4-3-6-13-7-5-10-15(12-13)14-8-1-2-9-14/h5,7,10,12,14H,1-4,6,8-9,11,16H2.
What are the key properties of 4-(3-cyclopentylphenyl)butan-1-amine?
4-(3-cyclopentylphenyl)butan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylphenyl)butan-1-amine is sourced from PubChem (CID 117310057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).