2-(1H-indol-5-yl)-N-methylethenesulfonamide

C11H12N2O2S — CID 54193929

IUPAC2-(1H-indol-5-yl)-N-methylethenesulfonamide
SMILESCNS(=O)(=O)C=Cc1ccc2[nH]ccc2c1
InChIInChI=1S/C11H12N2O2S/c1-12-16(14,15)7-5-9-2-3-11-10(8-9)4-6-13-11/h2-8,12-13H,1H3
InChIKeyPKLARCZPXGMPRD-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.69
Rot. Bonds3

About 2-(1H-indol-5-yl)-N-methylethenesulfonamide

2-(1H-indol-5-yl)-N-methylethenesulfonamide (PubChem CID 54193929) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is 2-(1H-indol-5-yl)-N-methylethenesulfonamide.

Molecular Properties

Compound Name2-(1H-indol-5-yl)-N-methylethenesulfonamide
PubChem CID54193929
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name2-(1H-indol-5-yl)-N-methylethenesulfonamide
SMILESCNS(=O)(=O)C=Cc1ccc2[nH]ccc2c1
InChIInChI=1S/C11H12N2O2S/c1-12-16(14,15)7-5-9-2-3-11-10(8-9)4-6-13-11/h2-8,12-13H,1H3
InChIKeyPKLARCZPXGMPRD-UHFFFAOYSA-N
XLogP1.69
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(Z)-2-chloroethenyl]-1H-indole
CID 145444556
5-(2-nitroethenyl)-1H-indole
CID 54465016
5-[(E)-2-(4-iodophenyl)ethenyl]-1H-indole
CID 135043581
5-(2-pyridin-4-ylethenyl)-1H-indole
CID 54050993
(E)-3-(1H-indol-5-yl)prop-2-en-1-amine
CID 117276942
N-[4-(1H-indol-5-yl)but-3-enyl]acetamide
CID 170488817
(E)-N-methyl-2-phenylethenesulfonamide
CID 2427246
S-[3-(1H-indol-5-yl)prop-2-enyl] ethanethioate
CID 169457351
(E)-3-(1H-indol-5-yl)-2-methylsulfonylprop-2-enenitrile
CID 119093630
5-[(E)-3-(sulfinoamino)prop-1-enyl]-1H-indole
CID 89272280
5-(4-bromobut-1-enyl)-1H-indole
CID 170497591
4-(1H-indol-5-yl)but-3-en-1-amine
CID 170487084

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-5-yl)-N-methylethenesulfonamide?
The IUPAC name of 2-(1H-indol-5-yl)-N-methylethenesulfonamide (CID 54193929) is 2-(1H-indol-5-yl)-N-methylethenesulfonamide.
What is the SMILES notation for 2-(1H-indol-5-yl)-N-methylethenesulfonamide?
The canonical SMILES for 2-(1H-indol-5-yl)-N-methylethenesulfonamide is CNS(=O)(=O)C=Cc1ccc2[nH]ccc2c1.
What is the InChIKey of 2-(1H-indol-5-yl)-N-methylethenesulfonamide?
The InChIKey is PKLARCZPXGMPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-12-16(14,15)7-5-9-2-3-11-10(8-9)4-6-13-11/h2-8,12-13H,1H3.
What are the key properties of 2-(1H-indol-5-yl)-N-methylethenesulfonamide?
2-(1H-indol-5-yl)-N-methylethenesulfonamide has a molecular weight of 236.30 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-5-yl)-N-methylethenesulfonamide is sourced from PubChem (CID 54193929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).