1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine

C15H24N2 — CID 116954314

IUPAC1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine
SMILESCNC(NC)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C15H24N2/c1-16-15(17-2)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h8-12,15-17H,3-7H2,1-2H3
InChIKeyQNCMQJKAUBWWDP-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.17
Rot. Bonds4

About 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine

1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine (PubChem CID 116954314) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine.

Molecular Properties

Compound Name1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine
PubChem CID116954314
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine
SMILESCNC(NC)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C15H24N2/c1-16-15(17-2)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h8-12,15-17H,3-7H2,1-2H3
InChIKeyQNCMQJKAUBWWDP-UHFFFAOYSA-N
XLogP3.17
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine 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-(4-cyclohexylphenyl)-N-methylethanamine
CID 43484988
1-(4-cyclohexylphenyl)-N'-methylmethanediamine
CID 116939287
1-cyclohexyl-1-(4-cyclohexylphenyl)-N-methylmethanamine
CID 43484996
1-(4-cyclohexylphenyl)-N,3-dimethylbutan-1-amine
CID 43484998
1-(4-cyclobutylphenyl)-1-cyclopropyl-N-methylmethanamine
CID 116505983
1-(4-cyclohexylphenyl)-N-methylpentan-1-amine
CID 43484983
4-(4-cyclohexylphenyl)-4-(methylamino)butanenitrile
CID 116955276
1-(4-cyclobutylphenyl)-2-cyclopentyl-N-methylethanamine
CID 105045068
[4-(1-methoxyethyl)phenyl]cycloheptane
CID 143858990
1-(4-cyclohexylphenyl)-N-methylpropan-2-amine
CID 82262296
1-(4-cyclohexylphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79755102
1-(4-cyclohexylphenyl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 43484975

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine?
The IUPAC name of 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine (CID 116954314) is 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine.
What is the SMILES notation for 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine?
The canonical SMILES for 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine is CNC(NC)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine?
The InChIKey is QNCMQJKAUBWWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-16-15(17-2)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h8-12,15-17H,3-7H2,1-2H3.
What are the key properties of 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine?
1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine has a molecular weight of 232.37 g/mol, XLogP of 3.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylphenyl)-N,N'-dimethylmethanediamine is sourced from PubChem (CID 116954314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).