N-methyl-2,3-dihydro-1H-indole-5-sulfonamide

C9H12N2O2S — CID 6502484

IUPACN-methyl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCNS(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C9H12N2O2S/c1-10-14(12,13)8-2-3-9-7(6-8)4-5-11-9/h2-3,6,10-11H,4-5H2,1H3
InChIKeyHXKOIZBLCHKMBW-UHFFFAOYSA-N
MW212.27 g/mol
LogP0.56
Rot. Bonds2

About N-methyl-2,3-dihydro-1H-indole-5-sulfonamide

N-methyl-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 6502484) has the molecular formula C9H12N2O2S and a molecular weight of 212.27 g/mol. Its IUPAC name is N-methyl-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-methyl-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID6502484
Molecular FormulaC9H12N2O2S
Molecular Weight212.27 g/mol
Exact Mass212.06
IUPAC NameN-methyl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCNS(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C9H12N2O2S/c1-10-14(12,13)8-2-3-9-7(6-8)4-5-11-9/h2-3,6,10-11H,4-5H2,1H3
InChIKeyHXKOIZBLCHKMBW-UHFFFAOYSA-N
XLogP0.56
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-methyl-2,3-dihydro-1H-indole-5-sulfonamide (CID 6502484) is N-methyl-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-methyl-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-methyl-2,3-dihydro-1H-indole-5-sulfonamide is CNS(=O)(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-methyl-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is HXKOIZBLCHKMBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2S/c1-10-14(12,13)8-2-3-9-7(6-8)4-5-11-9/h2-3,6,10-11H,4-5H2,1H3.
What are the key properties of N-methyl-2,3-dihydro-1H-indole-5-sulfonamide?
N-methyl-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 212.27 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 6502484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).