6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide

C19H16FN3O2 — CID 4732359

IUPAC6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide
SMILESCc1cc(C(=O)NNC(=O)Cc2ccccc2)c2cc(F)ccc2n1
InChIInChI=1S/C19H16FN3O2/c1-12-9-16(15-11-14(20)7-8-17(15)21-12)19(25)23-22-18(24)10-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,22,24)(H,23,25)
InChIKeyHMMZQTFEJDHIFK-UHFFFAOYSA-N
MW337.35 g/mol
LogP2.69
Rot. Bonds3

About 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide

6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide (PubChem CID 4732359) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide.

Molecular Properties

Compound Name6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide
PubChem CID4732359
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC Name6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide
SMILESCc1cc(C(=O)NNC(=O)Cc2ccccc2)c2cc(F)ccc2n1
InChIInChI=1S/C19H16FN3O2/c1-12-9-16(15-11-14(20)7-8-17(15)21-12)19(25)23-22-18(24)10-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,22,24)(H,23,25)
InChIKeyHMMZQTFEJDHIFK-UHFFFAOYSA-N
XLogP2.69
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
CID 4732291
6-fluoro-N'-(4-fluorobenzoyl)-2-methylquinoline-4-carbohydrazide
CID 4732337
6-fluoro-2-methyl-N'-(pyridine-2-carbonyl)quinoline-4-carbohydrazide
CID 4732352
N-[(1S)-1,2-diphenylethyl]-6-fluoro-2-methylquinoline-4-carboxamide
CID 7237810
6-fluoro-N-(2-hydroxypropyl)-2-methylquinoline-4-carboxamide
CID 110489253
6-fluoro-N-(3-hydroxyphenyl)-2-methylquinoline-4-carboxamide
CID 108789542
methyl 3-(6-fluoro-2-methylquinolin-4-yl)-3-oxopropanoate
CID 82666021
6-fluoro-2-methyl-N-(6-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 4732250
2-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]-5-iodobenzoic acid
CID 108789589
2-methyl-N'-[2-(1-methylbenzimidazol-2-yl)acetyl]quinoline-4-carbohydrazide
CID 4789695
5-bromo-2-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]benzoic acid
CID 108789645
2-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]pentanedioic acid
CID 108789630

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide?
The IUPAC name of 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide (CID 4732359) is 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide.
What is the SMILES notation for 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide?
The canonical SMILES for 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide is Cc1cc(C(=O)NNC(=O)Cc2ccccc2)c2cc(F)ccc2n1.
What is the InChIKey of 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide?
The InChIKey is HMMZQTFEJDHIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-12-9-16(15-11-14(20)7-8-17(15)21-12)19(25)23-22-18(24)10-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide?
6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide has a molecular weight of 337.35 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-N'-(2-phenylacetyl)quinoline-4-carbohydrazide is sourced from PubChem (CID 4732359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).