5-ethyl-1H-indole-3-sulfonyl chloride

C10H10ClNO2S — CID 82374069

IUPAC5-ethyl-1H-indole-3-sulfonyl chloride
SMILESCCc1ccc2[nH]cc(S(=O)(=O)Cl)c2c1
InChIInChI=1S/C10H10ClNO2S/c1-2-7-3-4-9-8(5-7)10(6-12-9)15(11,13)14/h3-6,12H,2H2,1H3
InChIKeyYMNSXMOQQCGGMF-UHFFFAOYSA-N
MW243.72 g/mol
LogP2.66
Rot. Bonds2

About 5-ethyl-1H-indole-3-sulfonyl chloride

5-ethyl-1H-indole-3-sulfonyl chloride (PubChem CID 82374069) has the molecular formula C10H10ClNO2S and a molecular weight of 243.72 g/mol. Its IUPAC name is 5-ethyl-1H-indole-3-sulfonyl chloride.

Molecular Properties

Compound Name5-ethyl-1H-indole-3-sulfonyl chloride
PubChem CID82374069
Molecular FormulaC10H10ClNO2S
Molecular Weight243.72 g/mol
Exact Mass243.01
IUPAC Name5-ethyl-1H-indole-3-sulfonyl chloride
SMILESCCc1ccc2[nH]cc(S(=O)(=O)Cl)c2c1
InChIInChI=1S/C10H10ClNO2S/c1-2-7-3-4-9-8(5-7)10(6-12-9)15(11,13)14/h3-6,12H,2H2,1H3
InChIKeyYMNSXMOQQCGGMF-UHFFFAOYSA-N
XLogP2.66
TPSA49.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.72
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-ethyl-3-(4-methoxyphenyl)sulfonyl-1H-quinolin-4-one
CID 2137956
1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine
CID 82490825
3-(4-ethylphenyl)sulfonyl-6-hydroxy-1H-quinolin-4-one
CID 167344437
1-(5-ethyl-1H-indol-3-yl)-2-(methylamino)ethanone
CID 82493050
5-bromo-6-chloro-1H-indole-3-sulfonyl chloride
CID 135201370
6-ethoxy-3-(4-ethylphenyl)sulfonyl-1H-quinolin-4-one
CID 18590251
3-(5-ethyl-1H-indol-3-yl)butanoic acid
CID 82277503
2-[3-(benzenesulfonyl)-1H-indol-5-yl]ethanol
CID 58955092
2-[3-(benzenesulfonyl)-1H-indol-5-yl]-N-methylethanamine
CID 24861016
4,5-dichloro-1H-indole-3-sulfonyl chloride
CID 82374073
1H-pyrrolo[2,3-c]pyridine-3-sulfonyl chloride
CID 83821681
6-nitro-1H-indole-3-sulfonyl chloride
CID 14736087

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1H-indole-3-sulfonyl chloride?
The IUPAC name of 5-ethyl-1H-indole-3-sulfonyl chloride (CID 82374069) is 5-ethyl-1H-indole-3-sulfonyl chloride.
What is the SMILES notation for 5-ethyl-1H-indole-3-sulfonyl chloride?
The canonical SMILES for 5-ethyl-1H-indole-3-sulfonyl chloride is CCc1ccc2[nH]cc(S(=O)(=O)Cl)c2c1.
What is the InChIKey of 5-ethyl-1H-indole-3-sulfonyl chloride?
The InChIKey is YMNSXMOQQCGGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNO2S/c1-2-7-3-4-9-8(5-7)10(6-12-9)15(11,13)14/h3-6,12H,2H2,1H3.
What are the key properties of 5-ethyl-1H-indole-3-sulfonyl chloride?
5-ethyl-1H-indole-3-sulfonyl chloride has a molecular weight of 243.72 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1H-indole-3-sulfonyl chloride is sourced from PubChem (CID 82374069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).