5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide

C19H15FN2O3 — CID 166336662

IUPAC5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide
SMILESCN1C(=O)CCc2cc(NC(=O)c3c(F)ccc4occc34)ccc21
InChIInChI=1S/C19H15FN2O3/c1-22-15-5-3-12(10-11(15)2-7-17(22)23)21-19(24)18-13-8-9-25-16(13)6-4-14(18)20/h3-6,8-10H,2,7H2,1H3,(H,21,24)
InChIKeyDLNLQRSTOQYLFM-UHFFFAOYSA-N
MW338.34 g/mol
LogP3.73
Rot. Bonds2

About 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide

5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide (PubChem CID 166336662) has the molecular formula C19H15FN2O3 and a molecular weight of 338.34 g/mol. Its IUPAC name is 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide
PubChem CID166336662
Molecular FormulaC19H15FN2O3
Molecular Weight338.34 g/mol
Exact Mass338.11
IUPAC Name5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide
SMILESCN1C(=O)CCc2cc(NC(=O)c3c(F)ccc4occc34)ccc21
InChIInChI=1S/C19H15FN2O3/c1-22-15-5-3-12(10-11(15)2-7-17(22)23)21-19(24)18-13-8-9-25-16(13)6-4-14(18)20/h3-6,8-10H,2,7H2,1H3,(H,21,24)
InChIKeyDLNLQRSTOQYLFM-UHFFFAOYSA-N
XLogP3.73
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.34
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)furan-2-carboxamide
CID 18571249
3-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
CID 18571247
1-(4-fluorophenyl)-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)urea
CID 30376046
4-tert-butyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
CID 18571261
N-(1-butyl-2-oxo-3,4-dihydroquinolin-6-yl)-2,6-difluorobenzamide
CID 16926960
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
1-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-phenylurea
CID 30376036
4-[(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-7-yl)carbamoyl]benzoic acid
CID 19760245
1-(3,4-dichlorophenyl)-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)urea
CID 30376030
2,5-difluoro-N-(1-methyl-2-oxo-3H-indol-5-yl)benzamide
CID 99842043
1-(1,3-benzodioxol-5-yl)-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)urea
CID 30376109

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide?
The IUPAC name of 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide (CID 166336662) is 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide.
What is the SMILES notation for 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide?
The canonical SMILES for 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide is CN1C(=O)CCc2cc(NC(=O)c3c(F)ccc4occc34)ccc21.
What is the InChIKey of 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide?
The InChIKey is DLNLQRSTOQYLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O3/c1-22-15-5-3-12(10-11(15)2-7-17(22)23)21-19(24)18-13-8-9-25-16(13)6-4-14(18)20/h3-6,8-10H,2,7H2,1H3,(H,21,24).
What are the key properties of 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide?
5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide has a molecular weight of 338.34 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-1-benzofuran-4-carboxamide is sourced from PubChem (CID 166336662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).