2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride

C15H17ClN2O — CID 170900117

IUPAC2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride
SMILESCc1ccc(NC(=O)c2ccccc2N)c(C)c1.Cl
InChIInChI=1S/C15H16N2O.ClH/c1-10-7-8-14(11(2)9-10)17-15(18)12-5-3-4-6-13(12)16;/h3-9H,16H2,1-2H3,(H,17,18);1H
InChIKeyWYODQZCVQKBNQS-UHFFFAOYSA-N
MW276.77 g/mol
LogP3.56
Rot. Bonds2

About 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride

2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride (PubChem CID 170900117) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride
PubChem CID170900117
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride
SMILESCc1ccc(NC(=O)c2ccccc2N)c(C)c1.Cl
InChIInChI=1S/C15H16N2O.ClH/c1-10-7-8-14(11(2)9-10)17-15(18)12-5-3-4-6-13(12)16;/h3-9H,16H2,1-2H3,(H,17,18);1H
InChIKeyWYODQZCVQKBNQS-UHFFFAOYSA-N
XLogP3.56
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 53.56
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

N-(2,4-dimethylphenyl)-2-fluorobenzamide
CID 579639
2-amino-N-(2-ethoxy-4-methylphenyl)benzamide
CID 60933793
2-benzoyl-N-(2,4-dimethylphenyl)benzamide
CID 16624399
2-amino-N-(5-bromo-2-methylphenyl)benzamide
CID 43805810
3-bromo-N-(2,4-dimethylphenyl)-2-fluorobenzamide
CID 106543986
N-(4-bromo-2-methylphenyl)-2,4-dimethylbenzamide
CID 953255
[2-[(2-aminobenzoyl)amino]phenyl]carbamic acid
CID 69256283
3-amino-N-(4-iodo-2-methylphenyl)-2-methylbenzamide
CID 78984651
N-(2,4-dimethylphenyl)-2-pentoxybenzamide
CID 4946491
4-amino-N-(2,4-dimethylphenyl)benzamide
CID 835597
N-(2-amino-4-methylphenyl)naphthalene-1-carboxamide
CID 43259068
N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide
CID 103144625

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride (CID 170900117) is 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride is Cc1ccc(NC(=O)c2ccccc2N)c(C)c1.Cl.
What is the InChIKey of 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride?
The InChIKey is WYODQZCVQKBNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O.ClH/c1-10-7-8-14(11(2)9-10)17-15(18)12-5-3-4-6-13(12)16;/h3-9H,16H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride?
2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride has a molecular weight of 276.77 g/mol, XLogP of 3.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride is sourced from PubChem (CID 170900117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).