N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide

C16H16N2O3S2 — CID 110405666

IUPACN-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide
SMILESO=C1Nc2ccc(NS(=O)(=O)c3cccs3)cc2C12CCCC2
InChIInChI=1S/C16H16N2O3S2/c19-15-16(7-1-2-8-16)12-10-11(5-6-13(12)17-15)18-23(20,21)14-4-3-9-22-14/h3-6,9-10,18H,1-2,7-8H2,(H,17,19)
InChIKeyWOFSBBISWUURCW-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.31
Rot. Bonds3

About N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide

N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide (PubChem CID 110405666) has the molecular formula C16H16N2O3S2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide
PubChem CID110405666
Molecular FormulaC16H16N2O3S2
Molecular Weight348.45 g/mol
Exact Mass348.06
IUPAC NameN-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide
SMILESO=C1Nc2ccc(NS(=O)(=O)c3cccs3)cc2C12CCCC2
InChIInChI=1S/C16H16N2O3S2/c19-15-16(7-1-2-8-16)12-10-11(5-6-13(12)17-15)18-23(20,21)14-4-3-9-22-14/h3-6,9-10,18H,1-2,7-8H2,(H,17,19)
InChIKeyWOFSBBISWUURCW-UHFFFAOYSA-N
XLogP3.31
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)benzenesulfonamide
CID 110405654
N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-carboxamide
CID 110405577
2,4-dimethyl-N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)benzenesulfonamide
CID 110405656
3,5-dimethyl-N-(2-oxospiro[1H-indole-3,1'-cyclohexane]-5-yl)-1H-pyrazole-4-sulfonamide
CID 110405556
N-(2-oxospiro[1H-indole-3,1'-cyclobutane]-5-yl)quinoline-8-sulfonamide
CID 118169114
2-oxospiro[1H-indole-3,1'-cyclobutane]-5-sulfonyl chloride
CID 83853467
N-[4-(cyclohexylamino)phenyl]thiophene-2-sulfonamide
CID 112980784
N-(1,3-benzodioxol-5-yl)thiophene-2-sulfonamide
CID 651313
2,2-dimethyl-N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)propanamide
CID 110405573
5-chloro-N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)thiophene-2-sulfonamide
CID 110405814
2-methyl-N-(2-oxospiro[1H-indole-3,1'-cyclohexane]-5-yl)propanamide
CID 110405476
N-(3-hydroxy-4-methylphenyl)thiophene-2-sulfonamide
CID 3790087

Frequently Asked Questions

What is the IUPAC name of N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide (CID 110405666) is N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide is O=C1Nc2ccc(NS(=O)(=O)c3cccs3)cc2C12CCCC2.
What is the InChIKey of N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide?
The InChIKey is WOFSBBISWUURCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3S2/c19-15-16(7-1-2-8-16)12-10-11(5-6-13(12)17-15)18-23(20,21)14-4-3-9-22-14/h3-6,9-10,18H,1-2,7-8H2,(H,17,19).
What are the key properties of N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide?
N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide has a molecular weight of 348.45 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 110405666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).