N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide

C19H17N3O4S — CID 2546677

IUPACN-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccccn3)cc2)cc1
InChIInChI=1S/C19H17N3O4S/c1-26-16-9-5-15(6-10-16)22-27(24,25)17-11-7-14(8-12-17)21-19(23)18-4-2-3-13-20-18/h2-13,22H,1H3,(H,21,23)
InChIKeyPGARTWPGGRMPMF-UHFFFAOYSA-N
MW383.43 g/mol
LogP3.14
Rot. Bonds6

About N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide

N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide (PubChem CID 2546677) has the molecular formula C19H17N3O4S and a molecular weight of 383.43 g/mol. Its IUPAC name is N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
PubChem CID2546677
Molecular FormulaC19H17N3O4S
Molecular Weight383.43 g/mol
Exact Mass383.09
IUPAC NameN-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccccn3)cc2)cc1
InChIInChI=1S/C19H17N3O4S/c1-26-16-9-5-15(6-10-16)22-27(24,25)17-11-7-14(8-12-17)21-19(23)18-4-2-3-13-20-18/h2-13,22H,1H3,(H,21,23)
InChIKeyPGARTWPGGRMPMF-UHFFFAOYSA-N
XLogP3.14
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.43
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide (CID 2546677) is N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide is COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccccn3)cc2)cc1.
What is the InChIKey of N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The InChIKey is PGARTWPGGRMPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O4S/c1-26-16-9-5-15(6-10-16)22-27(24,25)17-11-7-14(8-12-17)21-19(23)18-4-2-3-13-20-18/h2-13,22H,1H3,(H,21,23).
What are the key properties of N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide has a molecular weight of 383.43 g/mol, XLogP of 3.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 2546677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).