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

C15H23N — CID 117310056

IUPAC4-(4-cyclopentylphenyl)butan-1-amine
SMILESNCCCCc1ccc(C2CCCC2)cc1
InChIInChI=1S/C15H23N/c16-12-4-3-5-13-8-10-15(11-9-13)14-6-1-2-7-14/h8-11,14H,1-7,12,16H2
InChIKeyOPWUTYIZIUQESY-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.63
Rot. Bonds5

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

4-(4-cyclopentylphenyl)butan-1-amine (PubChem CID 117310056) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 4-(4-cyclopentylphenyl)butan-1-amine.

Molecular Properties

Compound Name4-(4-cyclopentylphenyl)butan-1-amine
PubChem CID117310056
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name4-(4-cyclopentylphenyl)butan-1-amine
SMILESNCCCCc1ccc(C2CCCC2)cc1
InChIInChI=1S/C15H23N/c16-12-4-3-5-13-8-10-15(11-9-13)14-6-1-2-7-14/h8-11,14H,1-7,12,16H2
InChIKeyOPWUTYIZIUQESY-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'}

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Related Compounds

4-(3-cyclopentylphenyl)butan-1-amine
CID 117310057
4-[4-(oxolan-3-yl)phenyl]butan-1-amine
CID 117313253
4-[4-(4-aminobutyl)phenyl]butan-1-amine
CID 13016028
(4-cyclohexylphenyl)methanamine
CID 22246867
5-(4-cyclohexylphenyl)-3,3-dimethylpentan-1-amine
CID 65300733
N'-(4-cyclohexylphenyl)butane-1,4-diamine
CID 115200971
4-(4-cyclohexylphenyl)butanoic acid
CID 3041568
3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol
CID 115031605
3-(4-cyclobutylphenyl)-N-methylpropan-1-amine
CID 116506759
3-[4-(1-methylpyrrolidin-3-yl)phenyl]propan-1-amine
CID 84786356
1-fluoro-4-[4-[4-(7-fluoroheptyl)phenyl]cyclohexyl]benzene
CID 20663512
1-(4-cyclohexylphenyl)butane-1,4-diamine
CID 116933691

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopentylphenyl)butan-1-amine?
The IUPAC name of 4-(4-cyclopentylphenyl)butan-1-amine (CID 117310056) is 4-(4-cyclopentylphenyl)butan-1-amine.
What is the SMILES notation for 4-(4-cyclopentylphenyl)butan-1-amine?
The canonical SMILES for 4-(4-cyclopentylphenyl)butan-1-amine is NCCCCc1ccc(C2CCCC2)cc1.
What is the InChIKey of 4-(4-cyclopentylphenyl)butan-1-amine?
The InChIKey is OPWUTYIZIUQESY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c16-12-4-3-5-13-8-10-15(11-9-13)14-6-1-2-7-14/h8-11,14H,1-7,12,16H2.
What are the key properties of 4-(4-cyclopentylphenyl)butan-1-amine?
4-(4-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-(4-cyclopentylphenyl)butan-1-amine is sourced from PubChem (CID 117310056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).