1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine

C16H24ClN — CID 65390440

IUPAC1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine
SMILESCNC(c1cccc(Cl)c1)C1CCC(C)(C)CC1
InChIInChI=1S/C16H24ClN/c1-16(2)9-7-12(8-10-16)15(18-3)13-5-4-6-14(17)11-13/h4-6,11-12,15,18H,7-10H2,1-3H3
InChIKeyCHMSIHLVMOAOII-UHFFFAOYSA-N
MW265.83 g/mol
LogP4.82
Rot. Bonds3

About 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine

1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine (PubChem CID 65390440) has the molecular formula C16H24ClN and a molecular weight of 265.83 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine
PubChem CID65390440
Molecular FormulaC16H24ClN
Molecular Weight265.83 g/mol
Exact Mass265.16
IUPAC Name1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine
SMILESCNC(c1cccc(Cl)c1)C1CCC(C)(C)CC1
InChIInChI=1S/C16H24ClN/c1-16(2)9-7-12(8-10-16)15(18-3)13-5-4-6-14(17)11-13/h4-6,11-12,15,18H,7-10H2,1-3H3
InChIKeyCHMSIHLVMOAOII-UHFFFAOYSA-N
XLogP4.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.83
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine 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-chlorophenyl)-1-cycloheptyl-N-methylmethanamine
CID 65400043
1-(3-chlorophenyl)-N-methyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105106692
1-(4,4-dimethylcyclohexyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]methanamine
CID 116544532
1-(3-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65424185
(2R)-1,2-bis(3-chlorophenyl)-N,N'-dimethylethane-1,2-diamine
CID 166838557
1-(3-cyclopropyloxyphenyl)-1-(4,4-difluorocyclohexyl)-N-methylmethanamine
CID 105188648
1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
CID 65399402
1-cyclohexyl-N-methyl-1-(3-methylphenyl)methanamine
CID 60818000
N-[(3-chlorophenyl)-cyclooctylmethyl]propan-1-amine
CID 80610112
(1S)-1-(3-chlorophenyl)-N-[cyclopropyl(phenyl)methyl]ethanamine
CID 81366288
2-(3-chlorophenyl)-2-(4,4-dimethylcyclohexyl)oxyethanamine
CID 114340592
N-methyl-4-[methylamino-(3-methylphenyl)methyl]cyclohexan-1-amine
CID 116952360

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine (CID 65390440) is 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine is CNC(c1cccc(Cl)c1)C1CCC(C)(C)CC1.
What is the InChIKey of 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
The InChIKey is CHMSIHLVMOAOII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN/c1-16(2)9-7-12(8-10-16)15(18-3)13-5-4-6-14(17)11-13/h4-6,11-12,15,18H,7-10H2,1-3H3.
What are the key properties of 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine has a molecular weight of 265.83 g/mol, XLogP of 4.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 65390440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).