N-(benzenesulfonyl)-2-indol-1-ylacetamide

C16H14N2O3S — CID 87044187

IUPACN-(benzenesulfonyl)-2-indol-1-ylacetamide
SMILESO=C(Cn1ccc2ccccc21)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C16H14N2O3S/c19-16(17-22(20,21)14-7-2-1-3-8-14)12-18-11-10-13-6-4-5-9-15(13)18/h1-11H,12H2,(H,17,19)
InChIKeyGGGLIMHOKQAEEZ-UHFFFAOYSA-N
MW314.37 g/mol
LogP2.15
Rot. Bonds4

About N-(benzenesulfonyl)-2-indol-1-ylacetamide

N-(benzenesulfonyl)-2-indol-1-ylacetamide (PubChem CID 87044187) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is N-(benzenesulfonyl)-2-indol-1-ylacetamide.

Molecular Properties

Compound NameN-(benzenesulfonyl)-2-indol-1-ylacetamide
PubChem CID87044187
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC NameN-(benzenesulfonyl)-2-indol-1-ylacetamide
SMILESO=C(Cn1ccc2ccccc21)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C16H14N2O3S/c19-16(17-22(20,21)14-7-2-1-3-8-14)12-18-11-10-13-6-4-5-9-15(13)18/h1-11H,12H2,(H,17,19)
InChIKeyGGGLIMHOKQAEEZ-UHFFFAOYSA-N
XLogP2.15
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(benzenesulfonyl)-2-indol-1-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-dimethoxyphenyl)sulfonyl-2-indol-1-ylacetamide
CID 75404791
N-(3-chlorophenyl)sulfonyl-3-indol-1-ylpropanamide
CID 86997837
N'-(2-indol-1-ylacetyl)-2-phenylacetohydrazide
CID 17080293
ethane;2-indol-1-ylacetic acid;methanesulfonamide
CID 90844595
N'-acetyl-2-indol-1-ylacetohydrazide
CID 4587603
N-tert-butyl-2-indol-1-ylacetamide
CID 47348922
N-(1,3-dioxoisoindol-2-yl)-2-indol-1-ylacetamide
CID 17080239
(2R)-2-[(2-indol-1-ylacetyl)amino]-2-phenylacetic acid
CID 45491721
N-(cyanomethyl)-2-indol-1-ylacetamide
CID 55220475
2-[[(2-indol-1-ylacetyl)amino]carbamoyl]benzoic acid
CID 17080252
2-[(2-indol-1-ylacetyl)amino]butanoic acid
CID 119223861
N'-(2-indol-1-ylacetyl)-2,2-diphenylacetohydrazide
CID 17080273

Frequently Asked Questions

What is the IUPAC name of N-(benzenesulfonyl)-2-indol-1-ylacetamide?
The IUPAC name of N-(benzenesulfonyl)-2-indol-1-ylacetamide (CID 87044187) is N-(benzenesulfonyl)-2-indol-1-ylacetamide.
What is the SMILES notation for N-(benzenesulfonyl)-2-indol-1-ylacetamide?
The canonical SMILES for N-(benzenesulfonyl)-2-indol-1-ylacetamide is O=C(Cn1ccc2ccccc21)NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(benzenesulfonyl)-2-indol-1-ylacetamide?
The InChIKey is GGGLIMHOKQAEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c19-16(17-22(20,21)14-7-2-1-3-8-14)12-18-11-10-13-6-4-5-9-15(13)18/h1-11H,12H2,(H,17,19).
What are the key properties of N-(benzenesulfonyl)-2-indol-1-ylacetamide?
N-(benzenesulfonyl)-2-indol-1-ylacetamide has a molecular weight of 314.37 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzenesulfonyl)-2-indol-1-ylacetamide is sourced from PubChem (CID 87044187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).