3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide

C17H15FN2O2 — CID 18571247

IUPAC3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
SMILESCN1C(=O)CCc2cc(NC(=O)c3cccc(F)c3)ccc21
InChIInChI=1S/C17H15FN2O2/c1-20-15-7-6-14(10-11(15)5-8-16(20)21)19-17(22)12-3-2-4-13(18)9-12/h2-4,6-7,9-10H,5,8H2,1H3,(H,19,22)
InChIKeyCZVYDYDWWJVDNO-UHFFFAOYSA-N
MW298.32 g/mol
LogP2.99
Rot. Bonds2

About 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide

3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide (PubChem CID 18571247) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
PubChem CID18571247
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC Name3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
SMILESCN1C(=O)CCc2cc(NC(=O)c3cccc(F)c3)ccc21
InChIInChI=1S/C17H15FN2O2/c1-20-15-7-6-14(10-11(15)5-8-16(20)21)19-17(22)12-3-2-4-13(18)9-12/h2-4,6-7,9-10H,5,8H2,1H3,(H,19,22)
InChIKeyCZVYDYDWWJVDNO-UHFFFAOYSA-N
XLogP2.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-butyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
CID 18571261
1-(4-fluorophenyl)-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)urea
CID 30376046
4-[(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-7-yl)carbamoyl]benzoic acid
CID 19760245
2-chloro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
CID 27421932
2-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
CID 40805138
N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)furan-2-carboxamide
CID 18571249
1-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-phenylurea
CID 30376036
N-(1-methyl-2-oxo-3H-indol-5-yl)-3-(trifluoromethyl)benzamide
CID 18570780
N-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-3-fluorobenzamide
CID 27656132
2-methyl-2-[4-[(1-methyl-2-oxo-3,4-dihydroquinoline-6-carbonyl)amino]phenyl]propanoic acid
CID 120528737
5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide
CID 166336662
1-(4-fluorophenyl)-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-6-oxopyridazine-3-carboxamide
CID 136523875

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide?
The IUPAC name of 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide (CID 18571247) is 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide.
What is the SMILES notation for 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide?
The canonical SMILES for 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide is CN1C(=O)CCc2cc(NC(=O)c3cccc(F)c3)ccc21.
What is the InChIKey of 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide?
The InChIKey is CZVYDYDWWJVDNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c1-20-15-7-6-14(10-11(15)5-8-16(20)21)19-17(22)12-3-2-4-13(18)9-12/h2-4,6-7,9-10H,5,8H2,1H3,(H,19,22).
What are the key properties of 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide?
3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide has a molecular weight of 298.32 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide is sourced from PubChem (CID 18571247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).