1-(4-methylphenyl)cyclopentan-1-amine

C12H17N — CID 23460106

IUPAC1-(4-methylphenyl)cyclopentan-1-amine
SMILESCc1ccc(C2(N)CCCC2)cc1
InChIInChI=1S/C12H17N/c1-10-4-6-11(7-5-10)12(13)8-2-3-9-12/h4-7H,2-3,8-9,13H2,1H3
InChIKeyRESLJLKNUFHRCC-UHFFFAOYSA-N
MW175.28 g/mol
LogP2.72
Rot. Bonds1

About 1-(4-methylphenyl)cyclopentan-1-amine

1-(4-methylphenyl)cyclopentan-1-amine (PubChem CID 23460106) has the molecular formula C12H17N and a molecular weight of 175.28 g/mol. Its IUPAC name is 1-(4-methylphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(4-methylphenyl)cyclopentan-1-amine
PubChem CID23460106
Molecular FormulaC12H17N
Molecular Weight175.28 g/mol
Exact Mass175.14
IUPAC Name1-(4-methylphenyl)cyclopentan-1-amine
SMILESCc1ccc(C2(N)CCCC2)cc1
InChIInChI=1S/C12H17N/c1-10-4-6-11(7-5-10)12(13)8-2-3-9-12/h4-7H,2-3,8-9,13H2,1H3
InChIKeyRESLJLKNUFHRCC-UHFFFAOYSA-N
XLogP2.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)cyclopentan-1-amine?
The IUPAC name of 1-(4-methylphenyl)cyclopentan-1-amine (CID 23460106) is 1-(4-methylphenyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(4-methylphenyl)cyclopentan-1-amine?
The canonical SMILES for 1-(4-methylphenyl)cyclopentan-1-amine is Cc1ccc(C2(N)CCCC2)cc1.
What is the InChIKey of 1-(4-methylphenyl)cyclopentan-1-amine?
The InChIKey is RESLJLKNUFHRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-10-4-6-11(7-5-10)12(13)8-2-3-9-12/h4-7H,2-3,8-9,13H2,1H3.
What are the key properties of 1-(4-methylphenyl)cyclopentan-1-amine?
1-(4-methylphenyl)cyclopentan-1-amine has a molecular weight of 175.28 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)cyclopentan-1-amine is sourced from PubChem (CID 23460106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).