N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline

C15H24N2 — CID 65379472

IUPACN-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline
SMILESCc1ccccc1NC1(CN)CCC(C)CC1
InChIInChI=1S/C15H24N2/c1-12-7-9-15(11-16,10-8-12)17-14-6-4-3-5-13(14)2/h3-6,12,17H,7-11,16H2,1-2H3
InChIKeyHKVFCHQLZYFKQB-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.31
Rot. Bonds3

About N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline

N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline (PubChem CID 65379472) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline.

Molecular Properties

Compound NameN-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline
PubChem CID65379472
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline
SMILESCc1ccccc1NC1(CN)CCC(C)CC1
InChIInChI=1S/C15H24N2/c1-12-7-9-15(11-16,10-8-12)17-14-6-4-3-5-13(14)2/h3-6,12,17H,7-11,16H2,1-2H3
InChIKeyHKVFCHQLZYFKQB-UHFFFAOYSA-N
XLogP3.31
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 ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Dibenz(b,f)azepine
CID 9212
2,2,4-Trimethyl-1,2-dihydroquinoline
CID 8981
N-ethyl-3-methylaniline
CID 7603
N,N'-Di-o-tolylethylenediamine
CID 66759
N-Phenyl-p-toluidine
CID 12109
Benzylaniline
CID 66028
1,2-Ethanediamine, N1-ethyl-N1-(3-methylphenyl)-
CID 87984
Phenbenzamine
CID 13751
4,4'-Methylenebis(N-methylaniline)
CID 15735
Benzenamine, 4-methyl-N-(4-methylphenyl)-
CID 69293
2,N-Dimethylaniline
CID 69137
N-(2-Cyanophenyl)piperazine
CID 2735875

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline?
The IUPAC name of N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline (CID 65379472) is N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline.
What is the SMILES notation for N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline?
The canonical SMILES for N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline is Cc1ccccc1NC1(CN)CCC(C)CC1.
What is the InChIKey of N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline?
The InChIKey is HKVFCHQLZYFKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-7-9-15(11-16,10-8-12)17-14-6-4-3-5-13(14)2/h3-6,12,17H,7-11,16H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline?
N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline has a molecular weight of 232.37 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-4-methylcyclohexyl]-2-methylaniline is sourced from PubChem (CID 65379472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).