[1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine

C14H20ClN — CID 84799020

IUPAC[1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine
SMILESCc1ccc(C2(CN)CCCC2)c(C)c1Cl
InChIInChI=1S/C14H20ClN/c1-10-5-6-12(11(2)13(10)15)14(9-16)7-3-4-8-14/h5-6H,3-4,7-9,16H2,1-2H3
InChIKeySNPLGSGCVAZYPX-UHFFFAOYSA-N
MW237.77 g/mol
LogP3.73
Rot. Bonds2

About [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine

[1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine (PubChem CID 84799020) has the molecular formula C14H20ClN and a molecular weight of 237.77 g/mol. Its IUPAC name is [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine
PubChem CID84799020
Molecular FormulaC14H20ClN
Molecular Weight237.77 g/mol
Exact Mass237.13
IUPAC Name[1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine
SMILESCc1ccc(C2(CN)CCCC2)c(C)c1Cl
InChIInChI=1S/C14H20ClN/c1-10-5-6-12(11(2)13(10)15)14(9-16)7-3-4-8-14/h5-6H,3-4,7-9,16H2,1-2H3
InChIKeySNPLGSGCVAZYPX-UHFFFAOYSA-N
XLogP3.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine 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

[1-(2-chloro-3-fluoro-4-methylphenyl)cyclopentyl]methanamine
CID 117356566
3-[1-(aminomethyl)cyclobutyl]-2-chloro-6-methylphenol
CID 117324591
[1-(2,3-difluoro-4-methylphenyl)cyclohexyl]methanamine
CID 117351215
[1-(2,3,4-trimethylphenyl)cyclopropyl]methanamine
CID 116963513
2-[1-(aminomethyl)cyclopentyl]-3-chloro-4-methylphenol
CID 84800201
[1-(2,5-dimethylphenyl)cyclopentyl]methanamine
CID 82491829
[1-(6-chloro-2,3-dimethylphenyl)cyclohexyl]methanamine
CID 117382961
[1-(2-bromo-3-fluoro-4-methylphenyl)cyclopentyl]methanamine
CID 117461259
[1-(5-ethyl-2-methylphenyl)cyclopentyl]methanamine
CID 117310072
[1-(3-chloro-4-methylphenyl)cyclohexyl]methanamine
CID 83824553
[1-(3-chloro-2-fluoro-6-methylphenyl)cyclopentyl]methanamine
CID 84801366
[1-(2-methoxy-3,4-dimethylphenyl)cyclopropyl]methanamine
CID 117293943

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine?
The IUPAC name of [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine (CID 84799020) is [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine is Cc1ccc(C2(CN)CCCC2)c(C)c1Cl.
What is the InChIKey of [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine?
The InChIKey is SNPLGSGCVAZYPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN/c1-10-5-6-12(11(2)13(10)15)14(9-16)7-3-4-8-14/h5-6H,3-4,7-9,16H2,1-2H3.
What are the key properties of [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine?
[1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine has a molecular weight of 237.77 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-2,4-dimethylphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 84799020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).