2-(3-chloro-4-methylphenyl)cyclopentan-1-amine

C12H16ClN — CID 103852573

IUPAC2-(3-chloro-4-methylphenyl)cyclopentan-1-amine
SMILESCc1ccc(C2CCCC2N)cc1Cl
InChIInChI=1S/C12H16ClN/c1-8-5-6-9(7-11(8)13)10-3-2-4-12(10)14/h5-7,10,12H,2-4,14H2,1H3
InChIKeyLUFVNCPOUFFTBB-UHFFFAOYSA-N
MW209.72 g/mol
LogP3.24
Rot. Bonds1

About 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine

2-(3-chloro-4-methylphenyl)cyclopentan-1-amine (PubChem CID 103852573) has the molecular formula C12H16ClN and a molecular weight of 209.72 g/mol. Its IUPAC name is 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(3-chloro-4-methylphenyl)cyclopentan-1-amine
PubChem CID103852573
Molecular FormulaC12H16ClN
Molecular Weight209.72 g/mol
Exact Mass209.10
IUPAC Name2-(3-chloro-4-methylphenyl)cyclopentan-1-amine
SMILESCc1ccc(C2CCCC2N)cc1Cl
InChIInChI=1S/C12H16ClN/c1-8-5-6-9(7-11(8)13)10-3-2-4-12(10)14/h5-7,10,12H,2-4,14H2,1H3
InChIKeyLUFVNCPOUFFTBB-UHFFFAOYSA-N
XLogP3.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.72
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(3-chloro-4-methylphenyl)cyclopentyl]methanamine
CID 107561109
[2-(3-chloro-4-methylphenyl)cycloheptyl]methanamine
CID 107561112
1-chloro-2-(3-chloro-4-methylphenyl)cycloheptane
CID 107560894
cis-(1R,2R)-2-(4-chlorophenyl)cyclopentan-1-amine
CID 11095547
5-amino-6-(3-chloro-4-methylphenyl)piperidin-2-one
CID 106818871
2-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride
CID 21319672
3-(3-chloro-4-methylphenyl)-2-methylpyrrolidine
CID 106818311
2-(3-chloro-4-methylphenyl)-N-propylcycloheptan-1-amine
CID 107560907
2-(2,5-dimethylphenyl)cyclopentan-1-amine
CID 62605663
2-(2-methylquinolin-6-yl)cyclopentan-1-amine
CID 81224228
(1R)-2-(4-fluorophenyl)cyclopentan-1-amine
CID 70223067
(2S)-2-(3-chloro-4-methylphenyl)aziridine
CID 55263390

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine?
The IUPAC name of 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine (CID 103852573) is 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine.
What is the SMILES notation for 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine?
The canonical SMILES for 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine is Cc1ccc(C2CCCC2N)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine?
The InChIKey is LUFVNCPOUFFTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN/c1-8-5-6-9(7-11(8)13)10-3-2-4-12(10)14/h5-7,10,12H,2-4,14H2,1H3.
What are the key properties of 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine?
2-(3-chloro-4-methylphenyl)cyclopentan-1-amine has a molecular weight of 209.72 g/mol, XLogP of 3.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-methylphenyl)cyclopentan-1-amine is sourced from PubChem (CID 103852573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).