N-(1H-indol-6-yl)ethanesulfonamide

C10H12N2O2S — CID 110730845

IUPACN-(1H-indol-6-yl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc2cc[nH]c2c1
InChIInChI=1S/C10H12N2O2S/c1-2-15(13,14)12-9-4-3-8-5-6-11-10(8)7-9/h3-7,11-12H,2H2,1H3
InChIKeyHVGYINHKQJWWHJ-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.93
Rot. Bonds3

About N-(1H-indol-6-yl)ethanesulfonamide

N-(1H-indol-6-yl)ethanesulfonamide (PubChem CID 110730845) has the molecular formula C10H12N2O2S and a molecular weight of 224.28 g/mol. Its IUPAC name is N-(1H-indol-6-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(1H-indol-6-yl)ethanesulfonamide
PubChem CID110730845
Molecular FormulaC10H12N2O2S
Molecular Weight224.28 g/mol
Exact Mass224.06
IUPAC NameN-(1H-indol-6-yl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc2cc[nH]c2c1
InChIInChI=1S/C10H12N2O2S/c1-2-15(13,14)12-9-4-3-8-5-6-11-10(8)7-9/h3-7,11-12H,2H2,1H3
InChIKeyHVGYINHKQJWWHJ-UHFFFAOYSA-N
XLogP1.93
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indol-6-yl)butane-1-sulfonamide
CID 110730847
N-ethoxy-1H-indol-6-amine;dihydrobromide
CID 140506919
2-fluoro-N-(1H-indol-6-yl)benzenesulfonamide
CID 71954733
N-(2-methyl-3H-benzimidazol-5-yl)ethanesulfonamide
CID 64584356
3-chloro-N-(1H-indol-6-yl)-4-methoxybenzenesulfonamide
CID 110730867
5-(sulfamoylamino)-1H-indole
CID 112573166
5-(dimethylsulfamoylamino)-1H-indole
CID 22611354
3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide
CID 91210071
N-(1H-indol-6-yl)-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide
CID 110730877
1-(1H-indol-6-yl)-3-pentylurea
CID 155412349
ethanesulfonic acid;methyl 1H-indole-6-carboxylate
CID 175802798
N-(1H-indol-6-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110730882

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-6-yl)ethanesulfonamide?
The IUPAC name of N-(1H-indol-6-yl)ethanesulfonamide (CID 110730845) is N-(1H-indol-6-yl)ethanesulfonamide.
What is the SMILES notation for N-(1H-indol-6-yl)ethanesulfonamide?
The canonical SMILES for N-(1H-indol-6-yl)ethanesulfonamide is CCS(=O)(=O)Nc1ccc2cc[nH]c2c1.
What is the InChIKey of N-(1H-indol-6-yl)ethanesulfonamide?
The InChIKey is HVGYINHKQJWWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2S/c1-2-15(13,14)12-9-4-3-8-5-6-11-10(8)7-9/h3-7,11-12H,2H2,1H3.
What are the key properties of N-(1H-indol-6-yl)ethanesulfonamide?
N-(1H-indol-6-yl)ethanesulfonamide has a molecular weight of 224.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-6-yl)ethanesulfonamide is sourced from PubChem (CID 110730845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).