N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride

C15H23ClN2O — CID 119609179

IUPACN-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride
SMILESCc1ccccc1C(=O)NC1CCCCC1CN.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-6-2-4-8-13(11)15(18)17-14-9-5-3-7-12(14)10-16;/h2,4,6,8,12,14H,3,5,7,9-10,16H2,1H3,(H,17,18);1H
InChIKeyMUGDCDMAZVWCDM-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.66
Rot. Bonds3

About N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride

N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride (PubChem CID 119609179) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride
PubChem CID119609179
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride
SMILESCc1ccccc1C(=O)NC1CCCCC1CN.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11-6-2-4-8-13(11)15(18)17-14-9-5-3-7-12(14)10-16;/h2,4,6,8,12,14H,3,5,7,9-10,16H2,1H3,(H,17,18);1H
InChIKeyMUGDCDMAZVWCDM-UHFFFAOYSA-N
XLogP2.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-2-iodo-3-methylbenzamide;hydrochloride
CID 119610198
2-methyl-N-[(1S,2S)-2-[(2-methylbenzoyl)amino]cyclohexyl]benzamide
CID 979091
N-[1-[[2-(aminomethyl)cyclopentyl]amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide;hydrochloride
CID 119601989
N-[2-(aminomethyl)cyclopentyl]-2-[(2-fluorobenzoyl)amino]-3-methylbenzamide;hydrochloride
CID 119605190
N-[2-(aminomethyl)cyclopentyl]-2-methylsulfonylbenzamide
CID 119601875
N-[2-(aminomethyl)cyclopentyl]-2-benzoylbenzamide;hydrochloride
CID 119600470
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
N-[2-(aminomethyl)cyclohexyl]-2-methyl-6-phenylpyridine-3-carboxamide;dihydrochloride
CID 119610704
N-[2-(aminomethyl)cyclohexyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide;hydrochloride
CID 119612413
N-(2-aminocyclopropyl)-2-methylbenzamide
CID 43593725
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]benzamide
CID 94903786
N-[2-(aminomethyl)cyclopentyl]-2-anilinobenzamide
CID 119601108

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride (CID 119609179) is N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride is Cc1ccccc1C(=O)NC1CCCCC1CN.Cl.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride?
The InChIKey is MUGDCDMAZVWCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-11-6-2-4-8-13(11)15(18)17-14-9-5-3-7-12(14)10-16;/h2,4,6,8,12,14H,3,5,7,9-10,16H2,1H3,(H,17,18);1H.
What are the key properties of N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride?
N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride is sourced from PubChem (CID 119609179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).