N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide

C16H16FN3O3S — CID 113092568

IUPACN-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCN(C)c1ccc(F)cc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C16H16FN3O3S/c1-20(2)15-6-3-11(17)9-14(15)19-24(22,23)12-4-5-13-10(7-12)8-16(21)18-13/h3-7,9,19H,8H2,1-2H3,(H,18,21)
InChIKeyKVHFPYWVTSGMRR-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.19
Rot. Bonds4

About N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide

N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 113092568) has the molecular formula C16H16FN3O3S and a molecular weight of 349.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID113092568
Molecular FormulaC16H16FN3O3S
Molecular Weight349.39 g/mol
Exact Mass349.09
IUPAC NameN-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCN(C)c1ccc(F)cc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C16H16FN3O3S/c1-20(2)15-6-3-11(17)9-14(15)19-24(22,23)12-4-5-13-10(7-12)8-16(21)18-13/h3-7,9,19H,8H2,1-2H3,(H,18,21)
InChIKeyKVHFPYWVTSGMRR-UHFFFAOYSA-N
XLogP2.19
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluoro-2-methylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 7667496
N-[2-(dimethylamino)-5-fluorophenyl]-4-fluoro-3-methylbenzenesulfonamide
CID 113092544
4-fluoro-N-(2-oxo-1,3-dihydroindol-5-yl)benzenesulfonamide
CID 18570748
N-[(2,4-difluorophenyl)methyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110782261
N-(5-fluoro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110872393
2-oxo-1,3-dihydroindole-5-sulfonyl fluoride
CID 82284625
N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110604721
N,N-dimethyl-4-[(2-oxo-1,3-dihydroindol-5-yl)sulfonylamino]benzamide
CID 24580874
N-[4-(4-fluorophenyl)butyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110288772
N-(3-methylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 18197715
N-(3-bromophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 8015526
N-(2-chloro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 16562517

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 113092568) is N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide is CN(C)c1ccc(F)cc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is KVHFPYWVTSGMRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O3S/c1-20(2)15-6-3-11(17)9-14(15)19-24(22,23)12-4-5-13-10(7-12)8-16(21)18-13/h3-7,9,19H,8H2,1-2H3,(H,18,21).
What are the key properties of N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 349.39 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 113092568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).