5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide

C19H18FN3O4S — CID 118694956

IUPAC5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide
SMILESCc1cc(=O)[nH]c2ccc(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)cc12
InChIInChI=1S/C19H18FN3O4S/c1-11-8-18(24)22-17-7-4-12(9-14(11)17)21-19(25)15-10-13(5-6-16(15)20)28(26,27)23(2)3/h4-10H,1-3H3,(H,21,25)(H,22,24)
InChIKeyRUEUMQOPDPLICR-UHFFFAOYSA-N
MW403.44 g/mol
LogP2.48
Rot. Bonds4

About 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide

5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide (PubChem CID 118694956) has the molecular formula C19H18FN3O4S and a molecular weight of 403.44 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide
PubChem CID118694956
Molecular FormulaC19H18FN3O4S
Molecular Weight403.44 g/mol
Exact Mass403.10
IUPAC Name5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide
SMILESCc1cc(=O)[nH]c2ccc(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)cc12
InChIInChI=1S/C19H18FN3O4S/c1-11-8-18(24)22-17-7-4-12(9-14(11)17)21-19(25)15-10-13(5-6-16(15)20)28(26,27)23(2)3/h4-10H,1-3H3,(H,21,25)(H,22,24)
InChIKeyRUEUMQOPDPLICR-UHFFFAOYSA-N
XLogP2.48
TPSA99.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.44
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(dimethylsulfamoyl)-2-fluoro-N-methyl-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide
CID 118694996
5-(dimethylsulfamoyl)-2-(3-hydroxypyrrolidin-1-yl)-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide
CID 118695136
5-(diethylsulfamoyl)-2-fluoro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 26700730
5-(dimethylsulfamoyl)-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-(2-pyridin-3-ylpyrrolidin-1-yl)benzamide
CID 118695149
4-(dimethylsulfamoyl)-N-(4-fluoro-3-methylphenyl)benzamide
CID 110776363
5-chloro-N-[3-(dimethylsulfamoyl)phenyl]-2-fluorobenzamide
CID 9077073
2-chloro-N-(3-chloro-4-methylphenyl)-5-(dimethylsulfamoyl)benzamide
CID 2665830
N-(4-chlorophenyl)-5-(dimethylsulfamoyl)-2-iodobenzamide
CID 55771427
N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-yl-5-sulfamoylbenzamide
CID 118695192
2-bromo-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-5-morpholin-4-ylsulfonylbenzamide
CID 118695361
N-[3-[2-(dimethylamino)ethyl]-2-methyl-1H-indol-5-yl]-2,5-difluorobenzamide
CID 22611290
2,5-dichloro-N-[4-(dimethylsulfamoyl)phenyl]benzamide
CID 9494815

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide?
The IUPAC name of 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide (CID 118694956) is 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide is Cc1cc(=O)[nH]c2ccc(NC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)cc12.
What is the InChIKey of 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide?
The InChIKey is RUEUMQOPDPLICR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O4S/c1-11-8-18(24)22-17-7-4-12(9-14(11)17)21-19(25)15-10-13(5-6-16(15)20)28(26,27)23(2)3/h4-10H,1-3H3,(H,21,25)(H,22,24).
What are the key properties of 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide?
5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide has a molecular weight of 403.44 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-2-fluoro-N-(4-methyl-2-oxo-1H-quinolin-6-yl)benzamide is sourced from PubChem (CID 118694956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).