1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide

C16H17N3O3S — CID 110724562

IUPAC1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc2c(c1)CC(=O)N2C)c1ccncc1
InChIInChI=1S/C16H17N3O3S/c1-11(12-5-7-17-8-6-12)18-23(21,22)14-3-4-15-13(9-14)10-16(20)19(15)2/h3-9,11,18H,10H2,1-2H3
InChIKeyWRKCITSXSJVRIK-UHFFFAOYSA-N
MW331.40 g/mol
LogP1.64
Rot. Bonds4

About 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide

1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide (PubChem CID 110724562) has the molecular formula C16H17N3O3S and a molecular weight of 331.40 g/mol. Its IUPAC name is 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide.

Molecular Properties

Compound Name1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide
PubChem CID110724562
Molecular FormulaC16H17N3O3S
Molecular Weight331.40 g/mol
Exact Mass331.10
IUPAC Name1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc2c(c1)CC(=O)N2C)c1ccncc1
InChIInChI=1S/C16H17N3O3S/c1-11(12-5-7-17-8-6-12)18-23(21,22)14-3-4-15-13(9-14)10-16(20)19(15)2/h3-9,11,18H,10H2,1-2H3
InChIKeyWRKCITSXSJVRIK-UHFFFAOYSA-N
XLogP1.64
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.40
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide 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

1-methyl-2-oxo-N-(1-phenylethyl)-3H-indole-5-sulfonamide
CID 3163725
1-methyl-2-oxo-N-pyrimidin-2-yl-3H-indole-5-sulfonamide
CID 110756701
1-methyl-2-oxo-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-3H-indole-5-sulfonamide
CID 110347532
1-methyl-N-[3-methyl-1-(1,3-thiazol-2-yl)butyl]-2-oxo-3H-indole-5-sulfonamide
CID 110289697
N-[2-(ethylamino)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 62664588
N-[2-(diethylamino)propyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 112502246
1-methyl-N-(5-methylhexyl)-2-oxo-3H-indole-5-sulfonamide
CID 110672112
N,1-dimethyl-2-oxo-N-(pyridin-4-ylmethyl)-3H-indole-5-sulfonamide
CID 110724844
1-methyl-N-[4-(3-methylbutylamino)phenyl]-2-oxo-3H-indole-5-sulfonamide
CID 112985170
1-methyl-N-[(2S)-4-methyl-1-oxo-1-pyrrolidin-1-ylpentan-2-yl]-2-oxo-3H-indole-5-sulfonamide
CID 110351456
N-[1-(4-bromophenyl)-3,3,3-trifluoropropyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 146147662
N-(4-tert-butylphenyl)-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 25417077

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide?
The IUPAC name of 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide (CID 110724562) is 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide.
What is the SMILES notation for 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide?
The canonical SMILES for 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide is CC(NS(=O)(=O)c1ccc2c(c1)CC(=O)N2C)c1ccncc1.
What is the InChIKey of 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide?
The InChIKey is WRKCITSXSJVRIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3S/c1-11(12-5-7-17-8-6-12)18-23(21,22)14-3-4-15-13(9-14)10-16(20)19(15)2/h3-9,11,18H,10H2,1-2H3.
What are the key properties of 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide?
1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide has a molecular weight of 331.40 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-oxo-N-(1-pyridin-4-ylethyl)-3H-indole-5-sulfonamide is sourced from PubChem (CID 110724562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).