1-(4-pentan-3-ylphenyl)cyclopentan-1-amine

C16H25N — CID 117335251

IUPAC1-(4-pentan-3-ylphenyl)cyclopentan-1-amine
SMILESCCC(CC)c1ccc(C2(N)CCCC2)cc1
InChIInChI=1S/C16H25N/c1-3-13(4-2)14-7-9-15(10-8-14)16(17)11-5-6-12-16/h7-10,13H,3-6,11-12,17H2,1-2H3
InChIKeyAZILYIXZKGDLLZ-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.32
Rot. Bonds4

About 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine

1-(4-pentan-3-ylphenyl)cyclopentan-1-amine (PubChem CID 117335251) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(4-pentan-3-ylphenyl)cyclopentan-1-amine
PubChem CID117335251
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name1-(4-pentan-3-ylphenyl)cyclopentan-1-amine
SMILESCCC(CC)c1ccc(C2(N)CCCC2)cc1
InChIInChI=1S/C16H25N/c1-3-13(4-2)14-7-9-15(10-8-14)16(17)11-5-6-12-16/h7-10,13H,3-6,11-12,17H2,1-2H3
InChIKeyAZILYIXZKGDLLZ-UHFFFAOYSA-N
XLogP4.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(4-pentan-3-ylphenyl)cyclopentan-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

Frequently Asked Questions

What is the IUPAC name of 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine?
The IUPAC name of 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine (CID 117335251) is 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine?
The canonical SMILES for 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine is CCC(CC)c1ccc(C2(N)CCCC2)cc1.
What is the InChIKey of 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine?
The InChIKey is AZILYIXZKGDLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-3-13(4-2)14-7-9-15(10-8-14)16(17)11-5-6-12-16/h7-10,13H,3-6,11-12,17H2,1-2H3.
What are the key properties of 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine?
1-(4-pentan-3-ylphenyl)cyclopentan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-pentan-3-ylphenyl)cyclopentan-1-amine is sourced from PubChem (CID 117335251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).