4-methoxy-N-pyridin-2-ylbenzenesulfonamide

C12H12N2O3S — CID 1087331

IUPAC4-methoxy-N-pyridin-2-ylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C12H12N2O3S/c1-17-10-5-7-11(8-6-10)18(15,16)14-12-4-2-3-9-13-12/h2-9H,1H3,(H,13,14)
InChIKeyLKYSZEMWNWCNAM-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.89
Rot. Bonds4

About 4-methoxy-N-pyridin-2-ylbenzenesulfonamide

4-methoxy-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 1087331) has the molecular formula C12H12N2O3S and a molecular weight of 264.31 g/mol. Its IUPAC name is 4-methoxy-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-pyridin-2-ylbenzenesulfonamide
PubChem CID1087331
Molecular FormulaC12H12N2O3S
Molecular Weight264.31 g/mol
Exact Mass264.06
IUPAC Name4-methoxy-N-pyridin-2-ylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C12H12N2O3S/c1-17-10-5-7-11(8-6-10)18(15,16)14-12-4-2-3-9-13-12/h2-9H,1H3,(H,13,14)
InChIKeyLKYSZEMWNWCNAM-UHFFFAOYSA-N
XLogP1.89
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-((4-hydroxyphenyl)amino)-3-pyridinyl)-4-methoxybenzenesulfonamide
CID 3035714
N-[2-(4-hydroxyanilino)pyridin-3-yl]-4-methoxybenzenesulfonamide;hydrochloride
CID 11983308
4-methoxy-N-[2-(4-pyridinyl)ethyl]benzenesulfonamide
CID 688003
3,4-Dimethoxy-N-pyridin-3-yl-benzenesulfonamide
CID 778317
4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 809740
4-ethoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 676047
4-ethoxy-N-pyridin-3-ylbenzenesulfonamide
CID 729504
4-methoxy-N-pyrimidin-2-ylbenzenesulfonamide
CID 669141
1-[(4-methoxyphenyl)sulfonyl]-1H-pyrrole
CID 831626
1-(4-Methoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine
CID 1484980
N-methyl-N-(2-phenoxyethyl)-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 4885397
4-Methoxy-3-methyl-N-(3-pyridinylmethyl)benzenesulfonamide
CID 741472

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 4-methoxy-N-pyridin-2-ylbenzenesulfonamide (CID 1087331) is 4-methoxy-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-N-pyridin-2-ylbenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccccn2)cc1.
What is the InChIKey of 4-methoxy-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is LKYSZEMWNWCNAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3S/c1-17-10-5-7-11(8-6-10)18(15,16)14-12-4-2-3-9-13-12/h2-9H,1H3,(H,13,14).
What are the key properties of 4-methoxy-N-pyridin-2-ylbenzenesulfonamide?
4-methoxy-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 264.31 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 1087331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).