N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide

C14H13N3O4S — CID 2568741

IUPACN-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H13N3O4S/c1-10(18)17-22(20,21)12-7-5-11(6-8-12)16-14(19)13-4-2-3-9-15-13/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyLUCHOYLZGZGVIS-UHFFFAOYSA-N
MW319.34 g/mol
LogP1.16
Rot. Bonds4

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

N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide (PubChem CID 2568741) has the molecular formula C14H13N3O4S and a molecular weight of 319.34 g/mol. Its IUPAC name is N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide
PubChem CID2568741
Molecular FormulaC14H13N3O4S
Molecular Weight319.34 g/mol
Exact Mass319.06
IUPAC NameN-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H13N3O4S/c1-10(18)17-22(20,21)12-7-5-11(6-8-12)16-14(19)13-4-2-3-9-15-13/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyLUCHOYLZGZGVIS-UHFFFAOYSA-N
XLogP1.16
TPSA105.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide (CID 2568741) is N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide is CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1.
What is the InChIKey of N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide?
The InChIKey is LUCHOYLZGZGVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O4S/c1-10(18)17-22(20,21)12-7-5-11(6-8-12)16-14(19)13-4-2-3-9-15-13/h2-9H,1H3,(H,16,19)(H,17,18).
What are the key properties of N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide?
N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide has a molecular weight of 319.34 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(acetylsulfamoyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 2568741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).