1-methylindole-7-sulfonamide

C9H10N2O2S — CID 67982357

IUPAC1-methylindole-7-sulfonamide
SMILESCn1ccc2cccc(S(N)(=O)=O)c21
InChIInChI=1S/C9H10N2O2S/c1-11-6-5-7-3-2-4-8(9(7)11)14(10,12)13/h2-6H,1H3,(H2,10,12,13)
InChIKeyJLLDNQZEOSZNNN-UHFFFAOYSA-N
MW210.26 g/mol
LogP0.83
Rot. Bonds1

About 1-methylindole-7-sulfonamide

1-methylindole-7-sulfonamide (PubChem CID 67982357) has the molecular formula C9H10N2O2S and a molecular weight of 210.26 g/mol. Its IUPAC name is 1-methylindole-7-sulfonamide.

Molecular Properties

Compound Name1-methylindole-7-sulfonamide
PubChem CID67982357
Molecular FormulaC9H10N2O2S
Molecular Weight210.26 g/mol
Exact Mass210.05
IUPAC Name1-methylindole-7-sulfonamide
SMILESCn1ccc2cccc(S(N)(=O)=O)c21
InChIInChI=1S/C9H10N2O2S/c1-11-6-5-7-3-2-4-8(9(7)11)14(10,12)13/h2-6H,1H3,(H2,10,12,13)
InChIKeyJLLDNQZEOSZNNN-UHFFFAOYSA-N
XLogP0.83
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methylindole-7-sulfonamide?
The IUPAC name of 1-methylindole-7-sulfonamide (CID 67982357) is 1-methylindole-7-sulfonamide.
What is the SMILES notation for 1-methylindole-7-sulfonamide?
The canonical SMILES for 1-methylindole-7-sulfonamide is Cn1ccc2cccc(S(N)(=O)=O)c21.
What is the InChIKey of 1-methylindole-7-sulfonamide?
The InChIKey is JLLDNQZEOSZNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2S/c1-11-6-5-7-3-2-4-8(9(7)11)14(10,12)13/h2-6H,1H3,(H2,10,12,13).
What are the key properties of 1-methylindole-7-sulfonamide?
1-methylindole-7-sulfonamide has a molecular weight of 210.26 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylindole-7-sulfonamide is sourced from PubChem (CID 67982357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).