4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide

C17H13FN2O — CID 10660382

IUPAC4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide
SMILESCNC(=O)c1cnc2ccccc2c1-c1ccc(F)cc1
InChIInChI=1S/C17H13FN2O/c1-19-17(21)14-10-20-15-5-3-2-4-13(15)16(14)11-6-8-12(18)9-7-11/h2-10H,1H3,(H,19,21)
InChIKeyUQWNZTYGUVQLCX-UHFFFAOYSA-N
MW280.30 g/mol
LogP3.40
Rot. Bonds2

About 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide

4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide (PubChem CID 10660382) has the molecular formula C17H13FN2O and a molecular weight of 280.30 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide
PubChem CID10660382
Molecular FormulaC17H13FN2O
Molecular Weight280.30 g/mol
Exact Mass280.10
IUPAC Name4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide
SMILESCNC(=O)c1cnc2ccccc2c1-c1ccc(F)cc1
InChIInChI=1S/C17H13FN2O/c1-19-17(21)14-10-20-15-5-3-2-4-13(15)16(14)11-6-8-12(18)9-7-11/h2-10H,1H3,(H,19,21)
InChIKeyUQWNZTYGUVQLCX-UHFFFAOYSA-N
XLogP3.40
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl 4-(4-fluorophenyl)quinoline-3-carboxylate
CID 174611223
4-amino-2-(4-fluorophenyl)-N-methylpyrimidine-5-carboxamide
CID 83567202
(2-chlorophenyl)-(4-phenylquinolin-3-yl)methanone
CID 135033358
2-(4-fluorophenyl)-N-methylfuran-3-carboxamide
CID 71205421
N-methyl-4-[4-[(4-methylbenzoyl)amino]phenyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 162513592
4-chloro-N-(2-hydroxyethyl)quinoline-3-carboxamide
CID 44590767
4-anilino-N-ethyl-6-[3-fluoro-4-(methylcarbamoyl)phenyl]quinoline-3-carboxamide
CID 156547219
1-(4-phenylquinolin-3-yl)-3-pyridin-2-ylprop-2-en-1-one
CID 142752382
2-(4-fluorophenyl)-N-methylfuro[2,3-b]pyridine-3-carboxamide
CID 67452827
4-amino-N'-(2-fluorobenzoyl)quinoline-3-carbohydrazide
CID 39849188
5-N-[(4-fluorophenyl)methyl]-3-methoxy-2-N-methyl-4-phenylmethoxypyridine-2,5-dicarboxamide
CID 71482107
ethyl 4-(4-fluorophenyl)-2-methylquinoline-3-carboxylate
CID 11594733

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide (CID 10660382) is 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide is CNC(=O)c1cnc2ccccc2c1-c1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide?
The InChIKey is UQWNZTYGUVQLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O/c1-19-17(21)14-10-20-15-5-3-2-4-13(15)16(14)11-6-8-12(18)9-7-11/h2-10H,1H3,(H,19,21).
What are the key properties of 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide?
4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide has a molecular weight of 280.30 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-methylquinoline-3-carboxamide is sourced from PubChem (CID 10660382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).