1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide

C14H13N3O3S — CID 29037208

IUPAC1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide
SMILESCOc1ccc(NS(=O)(=O)Cc2ccccc2C#N)cn1
InChIInChI=1S/C14H13N3O3S/c1-20-14-7-6-13(9-16-14)17-21(18,19)10-12-5-3-2-4-11(12)8-15/h2-7,9,17H,10H2,1H3
InChIKeyXYNHRQIKMWXRNC-UHFFFAOYSA-N
MW303.34 g/mol
LogP1.90
Rot. Bonds5

About 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide

1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide (PubChem CID 29037208) has the molecular formula C14H13N3O3S and a molecular weight of 303.34 g/mol. Its IUPAC name is 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide.

Molecular Properties

Compound Name1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide
PubChem CID29037208
Molecular FormulaC14H13N3O3S
Molecular Weight303.34 g/mol
Exact Mass303.07
IUPAC Name1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide
SMILESCOc1ccc(NS(=O)(=O)Cc2ccccc2C#N)cn1
InChIInChI=1S/C14H13N3O3S/c1-20-14-7-6-13(9-16-14)17-21(18,19)10-12-5-3-2-4-11(12)8-15/h2-7,9,17H,10H2,1H3
InChIKeyXYNHRQIKMWXRNC-UHFFFAOYSA-N
XLogP1.90
TPSA92.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide 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-(2-cyanophenyl)-N-(4-ethylphenyl)methanesulfonamide
CID 29267673
1-(2-cyanophenyl)-N-thiophen-3-ylmethanesulfonamide
CID 66354772
N-(6-bromo-2-pyridinyl)-1-(2-cyanophenyl)methanesulfonamide
CID 43520677
1-(2-cyanophenyl)-N-(4-methyl-3-pyridinyl)methanesulfonamide
CID 63327321
1-(2-cyanophenyl)-N-(1,2,4-triazin-3-yl)methanesulfonamide
CID 114387989
2-methoxy-5-(sulfamoylamino)pyridine
CID 112573201
4-[(2-cyanophenyl)methylsulfonylamino]-2-hydroxybenzoic acid
CID 45330184
1-(2-cyanophenyl)-N-(3-fluoro-4-pyridinyl)methanesulfonamide
CID 107595131
1-(2-cyanophenyl)-N-(2,4,4-trimethylpentan-2-yl)methanesulfonamide
CID 60681191
1-(2-cyanophenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanesulfonamide
CID 103830213
2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide
CID 110301907
5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide
CID 47051131

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide?
The IUPAC name of 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide (CID 29037208) is 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide.
What is the SMILES notation for 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide?
The canonical SMILES for 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide is COc1ccc(NS(=O)(=O)Cc2ccccc2C#N)cn1.
What is the InChIKey of 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide?
The InChIKey is XYNHRQIKMWXRNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3S/c1-20-14-7-6-13(9-16-14)17-21(18,19)10-12-5-3-2-4-11(12)8-15/h2-7,9,17H,10H2,1H3.
What are the key properties of 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide?
1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide has a molecular weight of 303.34 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyanophenyl)-N-(6-methoxy-3-pyridinyl)methanesulfonamide is sourced from PubChem (CID 29037208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).