N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide

C24H19N3O3 — CID 6734416

IUPACN'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide
SMILESCOc1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C24H19N3O3/c1-30-22-14-8-6-12-18(22)23(28)26-27-24(29)19-15-21(16-9-3-2-4-10-16)25-20-13-7-5-11-17(19)20/h2-15H,1H3,(H,26,28)(H,27,29)
InChIKeyDHZURBSNXVXEBM-UHFFFAOYSA-N
MW397.43 g/mol
LogP3.99
Rot. Bonds4

About N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide

N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide (PubChem CID 6734416) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide.

Molecular Properties

Compound NameN'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide
PubChem CID6734416
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC NameN'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide
SMILESCOc1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C24H19N3O3/c1-30-22-14-8-6-12-18(22)23(28)26-27-24(29)19-15-21(16-9-3-2-4-10-16)25-20-13-7-5-11-17(19)20/h2-15H,1H3,(H,26,28)(H,27,29)
InChIKeyDHZURBSNXVXEBM-UHFFFAOYSA-N
XLogP3.99
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-methylphenoxy)acetyl]-2-phenylquinoline-4-carbohydrazide
CID 2309994
2-(4-chlorophenyl)-N'-(3,4,5-trimethoxybenzoyl)quinoline-4-carbohydrazide
CID 24540316
2-(4-methoxyphenyl)-N'-(2-methylpropanoyl)quinoline-4-carbohydrazide
CID 24542943
(2-methoxyphenyl) 2-phenylquinoline-4-carboxylate
CID 1128700
N-[2-(2-methoxyphenyl)ethyl]-2-phenylquinoline-4-carboxamide
CID 1257051
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate
CID 35832298
N-(4,5-dimethoxy-2-methylphenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 7923987
(2,6-dimethoxyphenyl) 2-phenylquinoline-4-carboxylate
CID 19101104
N-(4-chloro-2-methoxy-5-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 1328482
N-(4-methoxyphenyl)-2-phenylquinoline-4-carboxamide
CID 1035332
methyl 2-[[2-(2-methoxyphenyl)quinoline-4-carbonyl]amino]benzoate
CID 1012430
N'-(2,5-dimethylfuran-3-carbonyl)-2-(4-methoxyphenyl)quinoline-4-carbohydrazide
CID 9468216

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide?
The IUPAC name of N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide (CID 6734416) is N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide.
What is the SMILES notation for N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide?
The canonical SMILES for N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide is COc1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide?
The InChIKey is DHZURBSNXVXEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c1-30-22-14-8-6-12-18(22)23(28)26-27-24(29)19-15-21(16-9-3-2-4-10-16)25-20-13-7-5-11-17(19)20/h2-15H,1H3,(H,26,28)(H,27,29).
What are the key properties of N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide?
N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide has a molecular weight of 397.43 g/mol, XLogP of 3.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxybenzoyl)-2-phenylquinoline-4-carbohydrazide is sourced from PubChem (CID 6734416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).