2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide

C15H13N3O2S — CID 106545745

IUPAC2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide
SMILESN#Cc1ncccc1S(=O)(=O)NC1CC1c1ccccc1
InChIInChI=1S/C15H13N3O2S/c16-10-14-15(7-4-8-17-14)21(19,20)18-13-9-12(13)11-5-2-1-3-6-11/h1-8,12-13,18H,9H2
InChIKeyHDIURDBDDSMNEB-UHFFFAOYSA-N
MW299.36 g/mol
LogP1.79
Rot. Bonds4

About 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide

2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide (PubChem CID 106545745) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide
PubChem CID106545745
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC Name2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide
SMILESN#Cc1ncccc1S(=O)(=O)NC1CC1c1ccccc1
InChIInChI=1S/C15H13N3O2S/c16-10-14-15(7-4-8-17-14)21(19,20)18-13-9-12(13)11-5-2-1-3-6-11/h1-8,12-13,18H,9H2
InChIKeyHDIURDBDDSMNEB-UHFFFAOYSA-N
XLogP1.79
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-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

N-(1-azabicyclo[2.2.2]octan-3-yl)-2-cyanopyridine-3-sulfonamide
CID 106595449
2-cyano-N-(2,4,6-tribromophenyl)pyridine-3-sulfonamide
CID 106595571
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-2-cyanopyridine-3-sulfonamide
CID 106596203
2-cyano-N-(2-cyanophenyl)pyridine-3-sulfonamide
CID 106595115
N-(4-bromo-2,6-dimethylphenyl)-2-cyanopyridine-3-sulfonamide
CID 106595530
2-cyano-N-(2-phenylpropyl)pyridine-3-sulfonamide
CID 106545234
2-cyano-N-(2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 106595467
2-cyano-N-(2-hydroxy-2-phenylethyl)pyridine-3-sulfonamide
CID 106546169
N-(5-azaspiro[3.5]nonan-8-yl)-2-cyanopyridine-3-sulfonamide
CID 106598352
2-cyano-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 106596256
2-cyano-N-ethoxypyridine-3-sulfonamide
CID 106593512
N-(6-amino-3-pyridinyl)-2-cyanopyridine-3-sulfonamide
CID 106598402

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide?
The IUPAC name of 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide (CID 106545745) is 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide is N#Cc1ncccc1S(=O)(=O)NC1CC1c1ccccc1.
What is the InChIKey of 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide?
The InChIKey is HDIURDBDDSMNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c16-10-14-15(7-4-8-17-14)21(19,20)18-13-9-12(13)11-5-2-1-3-6-11/h1-8,12-13,18H,9H2.
What are the key properties of 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide?
2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide has a molecular weight of 299.36 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(2-phenylcyclopropyl)pyridine-3-sulfonamide is sourced from PubChem (CID 106545745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).