2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide

C19H18N2O5S — CID 71886438

IUPAC2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide
SMILESCOc1ccc(Oc2ncccc2NS(=O)(=O)c2cc(C)ccc2O)cc1
InChIInChI=1S/C19H18N2O5S/c1-13-5-10-17(22)18(12-13)27(23,24)21-16-4-3-11-20-19(16)26-15-8-6-14(25-2)7-9-15/h3-12,21-22H,1-2H3
InChIKeyDJHNVOXGWWRSOD-UHFFFAOYSA-N
MW386.43 g/mol
LogP3.70
Rot. Bonds6

About 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide

2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide (PubChem CID 71886438) has the molecular formula C19H18N2O5S and a molecular weight of 386.43 g/mol. Its IUPAC name is 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide
PubChem CID71886438
Molecular FormulaC19H18N2O5S
Molecular Weight386.43 g/mol
Exact Mass386.09
IUPAC Name2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide
SMILESCOc1ccc(Oc2ncccc2NS(=O)(=O)c2cc(C)ccc2O)cc1
InChIInChI=1S/C19H18N2O5S/c1-13-5-10-17(22)18(12-13)27(23,24)21-16-4-3-11-20-19(16)26-15-8-6-14(25-2)7-9-15/h3-12,21-22H,1-2H3
InChIKeyDJHNVOXGWWRSOD-UHFFFAOYSA-N
XLogP3.70
TPSA97.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide?
The IUPAC name of 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide (CID 71886438) is 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide.
What is the SMILES notation for 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide?
The canonical SMILES for 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide is COc1ccc(Oc2ncccc2NS(=O)(=O)c2cc(C)ccc2O)cc1.
What is the InChIKey of 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide?
The InChIKey is DJHNVOXGWWRSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O5S/c1-13-5-10-17(22)18(12-13)27(23,24)21-16-4-3-11-20-19(16)26-15-8-6-14(25-2)7-9-15/h3-12,21-22H,1-2H3.
What are the key properties of 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide?
2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide has a molecular weight of 386.43 g/mol, XLogP of 3.70, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylbenzenesulfonamide is sourced from PubChem (CID 71886438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).