N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide

C11H12ClF2N3O3S — CID 114384041

IUPACN-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESNCC(F)(F)CNS(=O)(=O)c1cc2c(cc1Cl)NC(=O)C2
InChIInChI=1S/C11H12ClF2N3O3S/c12-7-3-8-6(2-10(18)17-8)1-9(7)21(19,20)16-5-11(13,14)4-15/h1,3,16H,2,4-5,15H2,(H,17,18)
InChIKeyDKCGXMVNWDFDEL-UHFFFAOYSA-N
MW339.75 g/mol
LogP0.71
Rot. Bonds5

About N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide

N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 114384041) has the molecular formula C11H12ClF2N3O3S and a molecular weight of 339.75 g/mol. Its IUPAC name is N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID114384041
Molecular FormulaC11H12ClF2N3O3S
Molecular Weight339.75 g/mol
Exact Mass339.03
IUPAC NameN-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESNCC(F)(F)CNS(=O)(=O)c1cc2c(cc1Cl)NC(=O)C2
InChIInChI=1S/C11H12ClF2N3O3S/c12-7-3-8-6(2-10(18)17-8)1-9(7)21(19,20)16-5-11(13,14)4-15/h1,3,16H,2,4-5,15H2,(H,17,18)
InChIKeyDKCGXMVNWDFDEL-UHFFFAOYSA-N
XLogP0.71
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.75
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide with MolForge

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 63194322
6-chloro-N-(2-hydroxyethyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 43502039
6-chloro-2-oxo-N-[2-(propan-2-ylamino)ethyl]-1,3-dihydroindole-5-sulfonamide
CID 62663889
N-(2-bromoprop-2-enyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 113465023
6-chloro-N-(2-hydroxypropyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 43502382
N-(2-amino-2-cyclopropylethyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 115301382
N-(2-amino-1-cyclopropylethyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 65188670
N-(2-amino-3-hydroxybutyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 64540623
N-(1-aminobutan-2-yl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 65194062
N-(3-amino-2,2-difluoropropyl)-5-bromo-2,4-dichlorobenzenesulfonamide;hydrochloride
CID 120713049
6-chloro-2-oxo-N-(1H-pyrazol-5-ylmethyl)-1,3-dihydroindole-5-sulfonamide
CID 61283170
N-(3-amino-2,2-difluoropropyl)-2-chloro-4-fluorobenzenesulfonamide
CID 114384009

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 114384041) is N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide is NCC(F)(F)CNS(=O)(=O)c1cc2c(cc1Cl)NC(=O)C2.
What is the InChIKey of N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is DKCGXMVNWDFDEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClF2N3O3S/c12-7-3-8-6(2-10(18)17-8)1-9(7)21(19,20)16-5-11(13,14)4-15/h1,3,16H,2,4-5,15H2,(H,17,18).
What are the key properties of N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 339.75 g/mol, XLogP of 0.71, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-difluoropropyl)-6-chloro-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 114384041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).