4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine

C15H24N2 — CID 116952308

IUPAC4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine
SMILESCNC(c1ccccc1C)C1CCC(N)CC1
InChIInChI=1S/C15H24N2/c1-11-5-3-4-6-14(11)15(17-2)12-7-9-13(16)10-8-12/h3-6,12-13,15,17H,7-10,16H2,1-2H3
InChIKeyRGLHTUMUJHCDAI-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.77
Rot. Bonds3

About 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine

4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine (PubChem CID 116952308) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine
PubChem CID116952308
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine
SMILESCNC(c1ccccc1C)C1CCC(N)CC1
InChIInChI=1S/C15H24N2/c1-11-5-3-4-6-14(11)15(17-2)12-7-9-13(16)10-8-12/h3-6,12-13,15,17H,7-10,16H2,1-2H3
InChIKeyRGLHTUMUJHCDAI-UHFFFAOYSA-N
XLogP2.77
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-N-methyl-1-(2-methylphenyl)methanamine
CID 60819765
N-methyl-1-(2-methylphenyl)-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105094933
4-[methylamino-(2,4,5-trimethylphenyl)methyl]cyclohexan-1-amine
CID 116952300
[cyclooctyl-(2-methylphenyl)methyl]hydrazine
CID 105254975
1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65424379
1-(2-cyclobutylphenyl)-1-cyclopropyl-N-methylmethanamine
CID 114602722
1-(2,3-dimethylphenyl)-1-(3-ethylcyclopentyl)-N-methylmethanamine
CID 65412191
1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine
CID 104789875
1-(3,4-dimethylcyclohexyl)-1-(2-fluoro-3-methylphenyl)-N-methylmethanamine
CID 104989351
N-[cyclobutyl-(2-methylphenyl)methyl]propan-1-amine
CID 64984085
1-cyclobutyl-1-(2-methoxyphenyl)-N-methylmethanamine
CID 64986514
5-[[cyclopropyl-(2-methylphenyl)methyl]carbamoyl]thiophene-2-carboxylic acid
CID 119184883

Frequently Asked Questions

What is the IUPAC name of 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine (CID 116952308) is 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine is CNC(c1ccccc1C)C1CCC(N)CC1.
What is the InChIKey of 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine?
The InChIKey is RGLHTUMUJHCDAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-5-3-4-6-14(11)15(17-2)12-7-9-13(16)10-8-12/h3-6,12-13,15,17H,7-10,16H2,1-2H3.
What are the key properties of 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine?
4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 116952308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).