N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine

C16H25N — CID 106829804

IUPACN-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)C1(C)CCCCC1
InChIInChI=1S/C16H25N/c1-13-8-7-9-14(12-13)15(17-3)16(2)10-5-4-6-11-16/h7-9,12,15,17H,4-6,10-11H2,1-3H3
InChIKeyLNOUHFMMDYXARG-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.23
Rot. Bonds3

About N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine

N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine (PubChem CID 106829804) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine
PubChem CID106829804
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)C1(C)CCCCC1
InChIInChI=1S/C16H25N/c1-13-8-7-9-14(12-13)15(17-3)16(2)10-5-4-6-11-16/h7-9,12,15,17H,4-6,10-11H2,1-3H3
InChIKeyLNOUHFMMDYXARG-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-(1-methylcyclopentyl)-1-(3-methylphenyl)methanamine
CID 115790477
N-methyl-1-(3-methylphenyl)-1-(1-phenylcyclopentyl)methanamine
CID 63417580
1-[methylamino-(3-methylphenyl)methyl]cyclopropan-1-amine
CID 116961273
N-methyl-1-(1-methylcyclohexyl)-1-naphthalen-2-ylmethanamine
CID 106830028
1-[methylamino-(3-methylphenyl)methyl]cyclobutane-1-carbonitrile
CID 116958707
1-(3-ethoxyphenyl)-N-methyl-1-(1-methylcyclopentyl)methanamine
CID 105022410
N-methyl-1-(3-methylphenyl)-1-(1-phenylcyclopropyl)methanamine
CID 63080920
1-(2-fluoro-5-methylphenyl)-N-methyl-1-(1-methylcyclohexyl)methanamine
CID 106830046
1-[hydrazinyl-(3-methylphenyl)methyl]-N,N-dimethylcycloheptan-1-amine
CID 105243818
1-(3,4-dimethoxyphenyl)-N-methyl-1-(1-methylcyclohexyl)methanamine
CID 106826825
N-methyl-1-(1-methylcyclohexyl)-1-(2-methylphenyl)methanamine
CID 106829818
1-(3-bromo-4-fluorophenyl)-N-methyl-1-(1-methylcyclohexyl)methanamine
CID 106827094

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine?
The IUPAC name of N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine (CID 106829804) is N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine is CNC(c1cccc(C)c1)C1(C)CCCCC1.
What is the InChIKey of N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine?
The InChIKey is LNOUHFMMDYXARG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-13-8-7-9-14(12-13)15(17-3)16(2)10-5-4-6-11-16/h7-9,12,15,17H,4-6,10-11H2,1-3H3.
What are the key properties of N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine?
N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine has a molecular weight of 231.38 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylcyclohexyl)-1-(3-methylphenyl)methanamine is sourced from PubChem (CID 106829804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).