5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide

C15H16ClN3O — CID 62241246

IUPAC5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide
SMILESCc1cccc(NC(=O)c2cc(Cl)ccc2NN)c1C
InChIInChI=1S/C15H16ClN3O/c1-9-4-3-5-13(10(9)2)18-15(20)12-8-11(16)6-7-14(12)19-17/h3-8,19H,17H2,1-2H3,(H,18,20)
InChIKeyBEXLJDYLSPFKCY-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.49
Rot. Bonds3

About 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide

5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide (PubChem CID 62241246) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide.

Molecular Properties

Compound Name5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide
PubChem CID62241246
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide
SMILESCc1cccc(NC(=O)c2cc(Cl)ccc2NN)c1C
InChIInChI=1S/C15H16ClN3O/c1-9-4-3-5-13(10(9)2)18-15(20)12-8-11(16)6-7-14(12)19-17/h3-8,19H,17H2,1-2H3,(H,18,20)
InChIKeyBEXLJDYLSPFKCY-UHFFFAOYSA-N
XLogP3.49
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide
CID 62236027
5-chloro-N-(3-chlorophenyl)-2-hydrazinylbenzamide
CID 55052324
6-chloro-N-(2,3-dimethylphenyl)-2-oxochromene-3-carboxamide
CID 2987293
5-chloro-N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzamide
CID 62242667
N-(2-carbamothioyl-3-methylphenyl)-5-chloro-2-methylbenzamide
CID 107805746
5-chloro-2-hydroxy-N-(2-methylphenyl)benzamide
CID 970572
5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
CID 107606119
7-chloro-N-(2,3-dimethylphenyl)-1-benzoxepine-4-carboxamide
CID 20896545
4-amino-3,5-dichloro-N-(2,3-dimethylphenyl)benzamide
CID 82826777
N-(5-bromo-4-methyl-2-pyridinyl)-5-chloro-2-hydrazinylbenzamide
CID 79729244
2-chloro-N-(2,3-dimethylphenyl)-6-hydrazinylpyridine-4-carboxamide
CID 62241615
2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide
CID 9342302

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide?
The IUPAC name of 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide (CID 62241246) is 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide.
What is the SMILES notation for 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide?
The canonical SMILES for 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide is Cc1cccc(NC(=O)c2cc(Cl)ccc2NN)c1C.
What is the InChIKey of 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide?
The InChIKey is BEXLJDYLSPFKCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-9-4-3-5-13(10(9)2)18-15(20)12-8-11(16)6-7-14(12)19-17/h3-8,19H,17H2,1-2H3,(H,18,20).
What are the key properties of 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide?
5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide has a molecular weight of 289.77 g/mol, XLogP of 3.49, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide is sourced from PubChem (CID 62241246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).