N-(benzenesulfonyl)pyridine-2-carboxamide

C12H10N2O3S — CID 23002400

IUPACN-(benzenesulfonyl)pyridine-2-carboxamide
SMILESO=C(NS(=O)(=O)c1ccccc1)c1ccccn1
InChIInChI=1S/C12H10N2O3S/c15-12(11-8-4-5-9-13-11)14-18(16,17)10-6-2-1-3-7-10/h1-9H,(H,14,15)
InChIKeyVFQFVVMOWYYJAQ-UHFFFAOYSA-N
MW262.29 g/mol
LogP1.20
Rot. Bonds3

About N-(benzenesulfonyl)pyridine-2-carboxamide

N-(benzenesulfonyl)pyridine-2-carboxamide (PubChem CID 23002400) has the molecular formula C12H10N2O3S and a molecular weight of 262.29 g/mol. Its IUPAC name is N-(benzenesulfonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(benzenesulfonyl)pyridine-2-carboxamide
PubChem CID23002400
Molecular FormulaC12H10N2O3S
Molecular Weight262.29 g/mol
Exact Mass262.04
IUPAC NameN-(benzenesulfonyl)pyridine-2-carboxamide
SMILESO=C(NS(=O)(=O)c1ccccc1)c1ccccn1
InChIInChI=1S/C12H10N2O3S/c15-12(11-8-4-5-9-13-11)14-18(16,17)10-6-2-1-3-7-10/h1-9H,(H,14,15)
InChIKeyVFQFVVMOWYYJAQ-UHFFFAOYSA-N
XLogP1.20
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(benzenesulfonyl)pyridine-2-carboxamide?
The IUPAC name of N-(benzenesulfonyl)pyridine-2-carboxamide (CID 23002400) is N-(benzenesulfonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(benzenesulfonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(benzenesulfonyl)pyridine-2-carboxamide is O=C(NS(=O)(=O)c1ccccc1)c1ccccn1.
What is the InChIKey of N-(benzenesulfonyl)pyridine-2-carboxamide?
The InChIKey is VFQFVVMOWYYJAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3S/c15-12(11-8-4-5-9-13-11)14-18(16,17)10-6-2-1-3-7-10/h1-9H,(H,14,15).
What are the key properties of N-(benzenesulfonyl)pyridine-2-carboxamide?
N-(benzenesulfonyl)pyridine-2-carboxamide has a molecular weight of 262.29 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzenesulfonyl)pyridine-2-carboxamide is sourced from PubChem (CID 23002400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).