N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide

C19H18N2O3S — CID 608033

IUPACN-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCOc1ccc(N(c2ccccn2)S(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H18N2O3S/c1-15-6-12-18(13-7-15)25(22,23)21(19-5-3-4-14-20-19)16-8-10-17(24-2)11-9-16/h3-14H,1-2H3
InChIKeyCNUSTKLOXLXPOE-UHFFFAOYSA-N
MW354.43 g/mol
LogP3.93
Rot. Bonds5

About N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide

N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 608033) has the molecular formula C19H18N2O3S and a molecular weight of 354.43 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide
PubChem CID608033
Molecular FormulaC19H18N2O3S
Molecular Weight354.43 g/mol
Exact Mass354.10
IUPAC NameN-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCOc1ccc(N(c2ccccn2)S(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C19H18N2O3S/c1-15-6-12-18(13-7-15)25(22,23)21(19-5-3-4-14-20-19)16-8-10-17(24-2)11-9-16/h3-14H,1-2H3
InChIKeyCNUSTKLOXLXPOE-UHFFFAOYSA-N
XLogP3.93
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide (CID 608033) is N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide is COc1ccc(N(c2ccccn2)S(=O)(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is CNUSTKLOXLXPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3S/c1-15-6-12-18(13-7-15)25(22,23)21(19-5-3-4-14-20-19)16-8-10-17(24-2)11-9-16/h3-14H,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide?
N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 354.43 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-methyl-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 608033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).