4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide

C13H14N2O3S — CID 3857714

IUPAC4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C13H14N2O3S/c1-10-4-3-5-13(14-10)15-19(16,17)12-8-6-11(18-2)7-9-12/h3-9H,1-2H3,(H,14,15)
InChIKeyJSCUWKAPBLUQDH-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.20
Rot. Bonds4

About 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide

4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide (PubChem CID 3857714) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
PubChem CID3857714
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Name4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C13H14N2O3S/c1-10-4-3-5-13(14-10)15-19(16,17)12-8-6-11(18-2)7-9-12/h3-9H,1-2H3,(H,14,15)
InChIKeyJSCUWKAPBLUQDH-UHFFFAOYSA-N
XLogP2.20
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-chloro-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 113456951
2-methoxy-5-[(6-methyl-2-pyridinyl)sulfamoyl]benzamide
CID 146024539
N-(4,6-dimethylpyrimidin-2-yl)-4-methoxybenzenesulfonamide
CID 717519
4-methoxy-N-[6-[(4-methoxy-3-methylphenyl)sulfonylamino]-2-pyridinyl]-3-methylbenzenesulfonamide
CID 71671343
2,5-dimethoxy-4-methyl-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 6463553
N-(6-chloro-2-pyridinyl)-4-ethoxybenzenesulfonamide
CID 104821273
N-(6-methyl-2-pyridinyl)-4-(pyrrolidine-1-carbonyl)benzenesulfonamide
CID 119055428
N-(6-methyl-2-pyridinyl)thiophene-2-sulfonamide
CID 893587
4-bromo-3-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 47071432
N-(6-methyl-2-pyridinyl)-1,3-dihydro-2-benzofuran-5-sulfonamide
CID 84584191
4-methoxy-N-phenylbenzenesulfonamide
CID 835273
4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide
CID 122302660

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide (CID 3857714) is 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2cccc(C)n2)cc1.
What is the InChIKey of 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The InChIKey is JSCUWKAPBLUQDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-10-4-3-5-13(14-10)15-19(16,17)12-8-6-11(18-2)7-9-12/h3-9H,1-2H3,(H,14,15).
What are the key properties of 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide has a molecular weight of 278.33 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 3857714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).