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

N-[1-(aminomethyl)cyclopropyl]-2-methylaniline
CID 106661294
N-[1-(aminomethyl)-3-(2-methylpropyl)cyclohexyl]-2-methylaniline
CID 107429092
4-methyl-1-(2-methylanilino)cyclohexane-1-carboxylic acid
CID 60992313
3-(aminomethyl)-N-(2-methylphenyl)-1,1-dioxothian-3-amine
CID 65376337
N-[1-(aminomethyl)-4-methylcyclohexyl]-1,2,4-benzotriazin-3-amine
CID 103205205
2-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]-N-(2-methylphenyl)acetamide
CID 62551845
N-[1-(aminomethyl)-4-methylcyclohexyl]quinazolin-2-amine
CID 114789938
N-[1-(aminomethyl)-4-methylcyclohexyl]-2,3-dimethylbenzamide
CID 63766094
N-[1-(aminomethyl)-3-methylcyclohexyl]-2-fluoroaniline
CID 65376483
N-[1-(aminomethyl)-3,5-dimethylcyclohexyl]-2-bromoaniline
CID 65383001
N-[1-(aminomethyl)cyclopropyl]-2-bromoaniline
CID 106661284
1-(aminomethyl)-N-(3-fluorophenyl)-4-methylcycloheptan-1-amine
CID 65383824

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).