8-methyl-N',2-diphenylquinoline-4-carbohydrazide

C23H19N3O — CID 4554842

IUPAC8-methyl-N',2-diphenylquinoline-4-carbohydrazide
SMILESCc1cccc2c(C(=O)NNc3ccccc3)cc(-c3ccccc3)nc12
InChIInChI=1S/C23H19N3O/c1-16-9-8-14-19-20(23(27)26-25-18-12-6-3-7-13-18)15-21(24-22(16)19)17-10-4-2-5-11-17/h2-15,25H,1H3,(H,26,27)
InChIKeyTWUIUEBRNHJJII-UHFFFAOYSA-N
MW353.43 g/mol
LogP4.97
Rot. Bonds4

About 8-methyl-N',2-diphenylquinoline-4-carbohydrazide

8-methyl-N',2-diphenylquinoline-4-carbohydrazide (PubChem CID 4554842) has the molecular formula C23H19N3O and a molecular weight of 353.43 g/mol. Its IUPAC name is 8-methyl-N',2-diphenylquinoline-4-carbohydrazide.

Molecular Properties

Compound Name8-methyl-N',2-diphenylquinoline-4-carbohydrazide
PubChem CID4554842
Molecular FormulaC23H19N3O
Molecular Weight353.43 g/mol
Exact Mass353.15
IUPAC Name8-methyl-N',2-diphenylquinoline-4-carbohydrazide
SMILESCc1cccc2c(C(=O)NNc3ccccc3)cc(-c3ccccc3)nc12
InChIInChI=1S/C23H19N3O/c1-16-9-8-14-19-20(23(27)26-25-18-12-6-3-7-13-18)15-21(24-22(16)19)17-10-4-2-5-11-17/h2-15,25H,1H3,(H,26,27)
InChIKeyTWUIUEBRNHJJII-UHFFFAOYSA-N
XLogP4.97
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-8-methyl-2-phenylquinoline-4-carboxamide
CID 3639002
N-(2-hydroxyethyl)-8-methyl-2-phenylquinoline-4-carboxamide
CID 5033603
N-(2,6-dimethylphenyl)-6,8-dimethyl-2-phenylquinoline-4-carboxamide
CID 19647461
8-chloro-N-(3-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 3105380
8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
CID 4746270
2-(3,4-dichlorophenyl)-8-methylquinoline-4-carboxylic acid
CID 5202236
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
7-chloro-N-(2,3-dimethylphenyl)-8-methyl-2-phenylquinoline-4-carboxamide
CID 3769705
8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate
CID 7139650
8-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 1261330
N'-[2-(2-methylphenoxy)acetyl]-2-phenylquinoline-4-carbohydrazide
CID 2309994
N-(2,3-dimethylphenyl)-2-(4-phenylphenyl)quinoline-4-carboxamide
CID 5129728

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N',2-diphenylquinoline-4-carbohydrazide?
The IUPAC name of 8-methyl-N',2-diphenylquinoline-4-carbohydrazide (CID 4554842) is 8-methyl-N',2-diphenylquinoline-4-carbohydrazide.
What is the SMILES notation for 8-methyl-N',2-diphenylquinoline-4-carbohydrazide?
The canonical SMILES for 8-methyl-N',2-diphenylquinoline-4-carbohydrazide is Cc1cccc2c(C(=O)NNc3ccccc3)cc(-c3ccccc3)nc12.
What is the InChIKey of 8-methyl-N',2-diphenylquinoline-4-carbohydrazide?
The InChIKey is TWUIUEBRNHJJII-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O/c1-16-9-8-14-19-20(23(27)26-25-18-12-6-3-7-13-18)15-21(24-22(16)19)17-10-4-2-5-11-17/h2-15,25H,1H3,(H,26,27).
What are the key properties of 8-methyl-N',2-diphenylquinoline-4-carbohydrazide?
8-methyl-N',2-diphenylquinoline-4-carbohydrazide has a molecular weight of 353.43 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N',2-diphenylquinoline-4-carbohydrazide is sourced from PubChem (CID 4554842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).