N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C13H11ClN2O4S — CID 71936048

IUPACN-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NS(=O)(=O)c2ccccc2Cl)c(=O)[nH]1
InChIInChI=1S/C13H11ClN2O4S/c1-8-6-7-9(12(17)15-8)13(18)16-21(19,20)11-5-3-2-4-10(11)14/h2-7H,1H3,(H,15,17)(H,16,18)
InChIKeyCACIWXPRPHQZHB-UHFFFAOYSA-N
MW326.76 g/mol
LogP1.46
Rot. Bonds3

About N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 71936048) has the molecular formula C13H11ClN2O4S and a molecular weight of 326.76 g/mol. Its IUPAC name is N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID71936048
Molecular FormulaC13H11ClN2O4S
Molecular Weight326.76 g/mol
Exact Mass326.01
IUPAC NameN-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NS(=O)(=O)c2ccccc2Cl)c(=O)[nH]1
InChIInChI=1S/C13H11ClN2O4S/c1-8-6-7-9(12(17)15-8)13(18)16-21(19,20)11-5-3-2-4-10(11)14/h2-7H,1H3,(H,15,17)(H,16,18)
InChIKeyCACIWXPRPHQZHB-UHFFFAOYSA-N
XLogP1.46
TPSA96.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.76
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 71936048) is N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)NS(=O)(=O)c2ccccc2Cl)c(=O)[nH]1.
What is the InChIKey of N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is CACIWXPRPHQZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O4S/c1-8-6-7-9(12(17)15-8)13(18)16-21(19,20)11-5-3-2-4-10(11)14/h2-7H,1H3,(H,15,17)(H,16,18).
What are the key properties of N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 326.76 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)sulfonyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 71936048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).