[1-(3,4-dimethylphenyl)cyclohexyl]methanamine

C15H23N — CID 62899225

IUPAC[1-(3,4-dimethylphenyl)cyclohexyl]methanamine
SMILESCc1ccc(C2(CN)CCCCC2)cc1C
InChIInChI=1S/C15H23N/c1-12-6-7-14(10-13(12)2)15(11-16)8-4-3-5-9-15/h6-7,10H,3-5,8-9,11,16H2,1-2H3
InChIKeyTVSFYVLGPDYXHR-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.46
Rot. Bonds2

About [1-(3,4-dimethylphenyl)cyclohexyl]methanamine

[1-(3,4-dimethylphenyl)cyclohexyl]methanamine (PubChem CID 62899225) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is [1-(3,4-dimethylphenyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(3,4-dimethylphenyl)cyclohexyl]methanamine
PubChem CID62899225
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name[1-(3,4-dimethylphenyl)cyclohexyl]methanamine
SMILESCc1ccc(C2(CN)CCCCC2)cc1C
InChIInChI=1S/C15H23N/c1-12-6-7-14(10-13(12)2)15(11-16)8-4-3-5-9-15/h6-7,10H,3-5,8-9,11,16H2,1-2H3
InChIKeyTVSFYVLGPDYXHR-UHFFFAOYSA-N
XLogP3.46
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [1-(3,4-dimethylphenyl)cyclohexyl]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-(3-chloro-4-methylphenyl)cyclohexyl]methanamine
CID 83824553
[1-(3,4-dimethylphenyl)cyclopent-3-en-1-yl]methanamine
CID 65353601
[1-(4-methyl-3-phenylphenyl)cyclopentyl]methanamine
CID 117418137
N-[[1-(3,4-dimethylphenyl)cyclohexyl]methyl]propan-2-amine
CID 63511609
[1-(3-chloro-4-methoxyphenyl)cyclohexyl]methanamine
CID 82499570
[1-(4-ethyl-3-methylphenyl)cyclopropyl]methanamine
CID 117281667
[1-(2-methyl-1-benzofuran-5-yl)cyclohexyl]methanamine
CID 117360718
[1-(4-bromophenyl)cyclopentyl]methanamine
CID 43119067
[2-(3,4-dimethylphenyl)-1,3-dioxan-2-yl]methanamine
CID 79017403
[1-(3-fluoro-4,5-dimethylphenyl)cyclopentyl]methanamine
CID 84788177
[1-(4-methoxy-3-methylsulfanylphenyl)cyclohexyl]methanamine
CID 117418161
[2-(3-methoxy-4-methylphenyl)spiro[3.4]octan-2-yl]methanamine
CID 65002969

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylphenyl)cyclohexyl]methanamine?
The IUPAC name of [1-(3,4-dimethylphenyl)cyclohexyl]methanamine (CID 62899225) is [1-(3,4-dimethylphenyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(3,4-dimethylphenyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(3,4-dimethylphenyl)cyclohexyl]methanamine is Cc1ccc(C2(CN)CCCCC2)cc1C.
What is the InChIKey of [1-(3,4-dimethylphenyl)cyclohexyl]methanamine?
The InChIKey is TVSFYVLGPDYXHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-6-7-14(10-13(12)2)15(11-16)8-4-3-5-9-15/h6-7,10H,3-5,8-9,11,16H2,1-2H3.
What are the key properties of [1-(3,4-dimethylphenyl)cyclohexyl]methanamine?
[1-(3,4-dimethylphenyl)cyclohexyl]methanamine has a molecular weight of 217.36 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethylphenyl)cyclohexyl]methanamine is sourced from PubChem (CID 62899225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).