N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide

C16H14F2N2O3S — CID 110383268

IUPACN-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
SMILESCN1C(=O)CCc2cc(S(=O)(=O)Nc3c(F)cccc3F)ccc21
InChIInChI=1S/C16H14F2N2O3S/c1-20-14-7-6-11(9-10(14)5-8-15(20)21)24(22,23)19-16-12(17)3-2-4-13(16)18/h2-4,6-7,9,19H,5,8H2,1H3
InChIKeySVBGWDYFQJNIJN-UHFFFAOYSA-N
MW352.36 g/mol
LogP2.67
Rot. Bonds3

About N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide

N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide (PubChem CID 110383268) has the molecular formula C16H14F2N2O3S and a molecular weight of 352.36 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
PubChem CID110383268
Molecular FormulaC16H14F2N2O3S
Molecular Weight352.36 g/mol
Exact Mass352.07
IUPAC NameN-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
SMILESCN1C(=O)CCc2cc(S(=O)(=O)Nc3c(F)cccc3F)ccc21
InChIInChI=1S/C16H14F2N2O3S/c1-20-14-7-6-11(9-10(14)5-8-15(20)21)24(22,23)19-16-12(17)3-2-4-13(16)18/h2-4,6-7,9,19H,5,8H2,1H3
InChIKeySVBGWDYFQJNIJN-UHFFFAOYSA-N
XLogP2.67
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110383269
1-methyl-2-oxo-N-(2,4,6-trimethylphenyl)-3,4-dihydroquinoline-6-sulfonamide
CID 110383213
N-(3-chlorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110383219
N-(2-chlorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110383218
N-(cyclopentylmethyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110627587
1-methyl-N-(6-methyl-2-pyridinyl)-2-oxo-4,5-dihydro-3H-1-benzazepine-7-sulfonamide
CID 119055282
1-methyl-N-(2-methyl-1,3-benzoxazol-7-yl)-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110417873
N-(2,6-difluorophenyl)-3,4-difluorobenzenesulfonamide
CID 8500850
N-[3-(4-fluorophenoxy)propyl]-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110428886
N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)methanesulfonamide
CID 16820558
1-methyl-2-oxo-N-pyrimidin-2-yl-3H-indole-5-sulfonamide
CID 110756701
N-cyclopropyl-2-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)sulfonylamino]acetamide
CID 110625100

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide?
The IUPAC name of N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide (CID 110383268) is N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide?
The canonical SMILES for N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide is CN1C(=O)CCc2cc(S(=O)(=O)Nc3c(F)cccc3F)ccc21.
What is the InChIKey of N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide?
The InChIKey is SVBGWDYFQJNIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O3S/c1-20-14-7-6-11(9-10(14)5-8-15(20)21)24(22,23)19-16-12(17)3-2-4-13(16)18/h2-4,6-7,9,19H,5,8H2,1H3.
What are the key properties of N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide?
N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide has a molecular weight of 352.36 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide is sourced from PubChem (CID 110383268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).