2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide

C15H17NO4S — CID 934507

IUPAC2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide
SMILESCOc1cccc(NS(=O)(=O)c2cc(C)ccc2OC)c1
InChIInChI=1S/C15H17NO4S/c1-11-7-8-14(20-3)15(9-11)21(17,18)16-12-5-4-6-13(10-12)19-2/h4-10,16H,1-3H3
InChIKeyYGJAZKIUNSOLTE-UHFFFAOYSA-N
MW307.37 g/mol
LogP2.81
Rot. Bonds5

About 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide

2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide (PubChem CID 934507) has the molecular formula C15H17NO4S and a molecular weight of 307.37 g/mol. Its IUPAC name is 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide
PubChem CID934507
Molecular FormulaC15H17NO4S
Molecular Weight307.37 g/mol
Exact Mass307.09
IUPAC Name2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide
SMILESCOc1cccc(NS(=O)(=O)c2cc(C)ccc2OC)c1
InChIInChI=1S/C15H17NO4S/c1-11-7-8-14(20-3)15(9-11)21(17,18)16-12-5-4-6-13(10-12)19-2/h4-10,16H,1-3H3
InChIKeyYGJAZKIUNSOLTE-UHFFFAOYSA-N
XLogP2.81
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide?
The IUPAC name of 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide (CID 934507) is 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide.
What is the SMILES notation for 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide?
The canonical SMILES for 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide is COc1cccc(NS(=O)(=O)c2cc(C)ccc2OC)c1.
What is the InChIKey of 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide?
The InChIKey is YGJAZKIUNSOLTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4S/c1-11-7-8-14(20-3)15(9-11)21(17,18)16-12-5-4-6-13(10-12)19-2/h4-10,16H,1-3H3.
What are the key properties of 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide?
2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide has a molecular weight of 307.37 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3-methoxyphenyl)-5-methylbenzenesulfonamide is sourced from PubChem (CID 934507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).