2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride

C15H23ClN2O — CID 119943682

IUPAC2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride
SMILESCC1CCCC(NC(=O)c2ccccc2N)C1C.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-10-6-5-9-14(11(10)2)17-15(18)12-7-3-4-8-13(12)16;/h3-4,7-8,10-11,14H,5-6,9,16H2,1-2H3,(H,17,18);1H
InChIKeyBVOGAPRIIRWVDS-UHFFFAOYSA-N
MW282.81 g/mol
LogP3.25
Rot. Bonds2

About 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride

2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride (PubChem CID 119943682) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride
PubChem CID119943682
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride
SMILESCC1CCCC(NC(=O)c2ccccc2N)C1C.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-10-6-5-9-14(11(10)2)17-15(18)12-7-3-4-8-13(12)16;/h3-4,7-8,10-11,14H,5-6,9,16H2,1-2H3,(H,17,18);1H
InChIKeyBVOGAPRIIRWVDS-UHFFFAOYSA-N
XLogP3.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(2-methoxycyclopentyl)benzamide
CID 62086922
4-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride
CID 119676181
N-(2,3-dimethylcyclohexyl)-2-fluoro-3-methylbenzamide
CID 80718134
4-amino-N-(2,3-dimethylcyclohexyl)-3-methylbenzamide
CID 16785407
5-amino-2-bromo-N-(2,3-dimethylcyclohexyl)-4-fluorobenzamide
CID 62814890
2-bromo-N-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]carbamothioyl]benzamide
CID 7041207
2-amino-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103951112
2-amino-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)benzamide;dihydrochloride
CID 119946727
3-amino-N-(2-methylcyclopentyl)-2-nitrobenzamide
CID 115549026
N-(2,3-dimethylcyclopentyl)-2-fluorobenzamide
CID 64907181
N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]pyridine-2-carboxamide
CID 11919862
2,5-dichloro-N-(2,3-dimethylcyclohexyl)benzamide
CID 43007916

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride (CID 119943682) is 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride is CC1CCCC(NC(=O)c2ccccc2N)C1C.Cl.
What is the InChIKey of 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride?
The InChIKey is BVOGAPRIIRWVDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-10-6-5-9-14(11(10)2)17-15(18)12-7-3-4-8-13(12)16;/h3-4,7-8,10-11,14H,5-6,9,16H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride?
2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 3.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride is sourced from PubChem (CID 119943682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).