4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide

C14H16N2O3S — CID 110752603

IUPAC4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)N(C)c2cccnc2)cc1C
InChIInChI=1S/C14H16N2O3S/c1-11-9-13(6-7-14(11)19-3)20(17,18)16(2)12-5-4-8-15-10-12/h4-10H,1-3H3
InChIKeySBHJSJJIPISGBU-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.22
Rot. Bonds4

About 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide

4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide (PubChem CID 110752603) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide
PubChem CID110752603
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)N(C)c2cccnc2)cc1C
InChIInChI=1S/C14H16N2O3S/c1-11-9-13(6-7-14(11)19-3)20(17,18)16(2)12-5-4-8-15-10-12/h4-10H,1-3H3
InChIKeySBHJSJJIPISGBU-UHFFFAOYSA-N
XLogP2.22
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide
CID 110752600
4-methoxy-N,3-dimethyl-N-pyridin-2-ylbenzenesulfonamide
CID 56816994
4-methoxy-3-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 741472
4-tert-butyl-N-methyl-N-pyridin-3-ylbenzenesulfonamide
CID 110752641
5-amino-4-bromo-2-methoxy-N-methyl-N-pyridin-3-ylbenzenesulfonamide
CID 81397679
3-amino-4-methoxy-N-methyl-N-phenylbenzenesulfonamide
CID 28542327
3-chloro-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzenesulfonamide
CID 100511071
4-methoxy-3-methyl-N-(4-pyridin-3-ylbutyl)benzenesulfonamide
CID 110661328
2-[(4-methoxy-3-methylphenyl)sulfonyl-methylamino]acetate
CID 6957292
2-[ethyl-(4-methoxy-3-methylphenyl)sulfonylamino]-N-methyl-N-phenylacetamide
CID 100798501
2-(N-(4-methoxy-3-methylphenyl)sulfonylanilino)-N-(pyridin-4-ylmethyl)acetamide
CID 30265589
2-[ethyl-(4-methoxy-3-methylphenyl)sulfonylamino]-N-(3-methoxyphenyl)-N-methylacetamide
CID 100798512

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide?
The IUPAC name of 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide (CID 110752603) is 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide is COc1ccc(S(=O)(=O)N(C)c2cccnc2)cc1C.
What is the InChIKey of 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide?
The InChIKey is SBHJSJJIPISGBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-11-9-13(6-7-14(11)19-3)20(17,18)16(2)12-5-4-8-15-10-12/h4-10H,1-3H3.
What are the key properties of 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide?
4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide has a molecular weight of 292.36 g/mol, XLogP of 2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,3-dimethyl-N-pyridin-3-ylbenzenesulfonamide is sourced from PubChem (CID 110752603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).