2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide

C13H11N3O4S — CID 115928413

IUPAC2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide
SMILESCOc1cc(C#N)ccc1Oc1ncccc1S(N)(=O)=O
InChIInChI=1S/C13H11N3O4S/c1-19-11-7-9(8-14)4-5-10(11)20-13-12(21(15,17)18)3-2-6-16-13/h2-7H,1H3,(H2,15,17,18)
InChIKeyWPQPSFQJBQBNLK-UHFFFAOYSA-N
MW305.32 g/mol
LogP1.40
Rot. Bonds4

About 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide

2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide (PubChem CID 115928413) has the molecular formula C13H11N3O4S and a molecular weight of 305.32 g/mol. Its IUPAC name is 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide
PubChem CID115928413
Molecular FormulaC13H11N3O4S
Molecular Weight305.32 g/mol
Exact Mass305.05
IUPAC Name2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide
SMILESCOc1cc(C#N)ccc1Oc1ncccc1S(N)(=O)=O
InChIInChI=1S/C13H11N3O4S/c1-19-11-7-9(8-14)4-5-10(11)20-13-12(21(15,17)18)3-2-6-16-13/h2-7H,1H3,(H2,15,17,18)
InChIKeyWPQPSFQJBQBNLK-UHFFFAOYSA-N
XLogP1.40
TPSA115.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(4-cyano-2-methoxyphenoxy)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

4-[(3-amino-2-pyridinyl)oxy]-3-methoxybenzonitrile
CID 16781104
2-(2-methoxyphenoxy)pyridine-3-sulfonamide
CID 112572908
ethyl 2-(4-cyano-2-methoxyphenoxy)pyridine-3-carboxylate
CID 47082860
2-(4-methoxyphenoxy)pyridine-3-sulfonamide
CID 112572912
2-(4-bromo-2-propan-2-ylphenoxy)pyridine-3-sulfonamide
CID 115928526
2-(2,5-dimethylphenoxy)pyridine-3-sulfonamide
CID 112572887
4-(4-chloro-2-methoxyphenoxy)-3-(2-methoxy-3-pyridinyl)benzonitrile
CID 66666696
5-(4-cyano-2-methoxyphenoxy)pyridine-2-carbonitrile
CID 115487862
4-(5-aminopyrimidin-4-yl)oxy-3-methoxybenzonitrile
CID 79915853
4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid
CID 43325992
2-(3-tert-butylphenoxy)pyridine-3-sulfonamide
CID 115928484
4-(2-ethylsulfonylethoxy)-3-methoxybenzonitrile
CID 43807788

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide?
The IUPAC name of 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide (CID 115928413) is 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide?
The canonical SMILES for 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide is COc1cc(C#N)ccc1Oc1ncccc1S(N)(=O)=O.
What is the InChIKey of 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide?
The InChIKey is WPQPSFQJBQBNLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O4S/c1-19-11-7-9(8-14)4-5-10(11)20-13-12(21(15,17)18)3-2-6-16-13/h2-7H,1H3,(H2,15,17,18).
What are the key properties of 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide?
2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide has a molecular weight of 305.32 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 115928413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).