N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide

C19H15FN2O2 — CID 46422715

IUPACN-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cc(C)nc3cc(F)ccc23)c1
InChIInChI=1S/C19H15FN2O2/c1-11-8-17(16-7-6-14(20)10-18(16)21-11)19(24)22-15-5-3-4-13(9-15)12(2)23/h3-10H,1-2H3,(H,22,24)
InChIKeyWYGPSKCYHRVAAB-UHFFFAOYSA-N
MW322.34 g/mol
LogP4.14
Rot. Bonds3

About N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide

N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide (PubChem CID 46422715) has the molecular formula C19H15FN2O2 and a molecular weight of 322.34 g/mol. Its IUPAC name is N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide
PubChem CID46422715
Molecular FormulaC19H15FN2O2
Molecular Weight322.34 g/mol
Exact Mass322.11
IUPAC NameN-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cc(C)nc3cc(F)ccc23)c1
InChIInChI=1S/C19H15FN2O2/c1-11-8-17(16-7-6-14(20)10-18(16)21-11)19(24)22-15-5-3-4-13(9-15)12(2)23/h3-10H,1-2H3,(H,22,24)
InChIKeyWYGPSKCYHRVAAB-UHFFFAOYSA-N
XLogP4.14
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.34
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide 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-N-(3-hydroxyphenyl)-2-methylquinoline-4-carboxamide
CID 108789542
N-[3-(1,3-dithiolan-2-yl)phenyl]-7-fluoro-2-methylquinoline-4-carboxamide
CID 55607065
N-[(3-acetamidophenyl)methyl]-7-fluoro-2-methylquinoline-4-carboxamide
CID 39575257
dimethyl 5-[(6-fluoro-2-methylquinoline-4-carbonyl)amino]benzene-1,3-dicarboxylate
CID 4732272
N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-7-fluoro-2-methylquinoline-4-carboxamide
CID 46686688
N-(4-benzamido-2,5-diethoxyphenyl)-7-fluoro-2-methylquinoline-4-carboxamide
CID 46686426
6-fluoro-2-methyl-N-(6-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 4732250
N-(3-acetylphenyl)-4,6-dimethylpyridine-2-carboxamide
CID 19224356
7-fluoro-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-methylquinoline-4-carboxamide
CID 56530756
1-acetyl-N-(3-acetylphenyl)-6-fluoroindole-3-carboxamide
CID 113213002
6-fluoro-2-methyl-N'-phenylquinoline-4-carbohydrazide
CID 4732291
2-methyl-N-[3-(trifluoromethoxy)phenyl]quinoline-4-carboxamide
CID 38258538

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide (CID 46422715) is N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide is CC(=O)c1cccc(NC(=O)c2cc(C)nc3cc(F)ccc23)c1.
What is the InChIKey of N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide?
The InChIKey is WYGPSKCYHRVAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O2/c1-11-8-17(16-7-6-14(20)10-18(16)21-11)19(24)22-15-5-3-4-13(9-15)12(2)23/h3-10H,1-2H3,(H,22,24).
What are the key properties of N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide?
N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide has a molecular weight of 322.34 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-7-fluoro-2-methylquinoline-4-carboxamide is sourced from PubChem (CID 46422715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).