N-methylsulfonylpyridine-2-carboxamide

C7H8N2O3S — CID 14952705

IUPACN-methylsulfonylpyridine-2-carboxamide
SMILESCS(=O)(=O)NC(=O)c1ccccn1
InChIInChI=1S/C7H8N2O3S/c1-13(11,12)9-7(10)6-4-2-3-5-8-6/h2-5H,1H3,(H,9,10)
InChIKeyCQGGSIAZHQWWBM-UHFFFAOYSA-N
MW200.22 g/mol
LogP-0.23
Rot. Bonds2

About N-methylsulfonylpyridine-2-carboxamide

N-methylsulfonylpyridine-2-carboxamide (PubChem CID 14952705) has the molecular formula C7H8N2O3S and a molecular weight of 200.22 g/mol. Its IUPAC name is N-methylsulfonylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-methylsulfonylpyridine-2-carboxamide
PubChem CID14952705
Molecular FormulaC7H8N2O3S
Molecular Weight200.22 g/mol
Exact Mass200.03
IUPAC NameN-methylsulfonylpyridine-2-carboxamide
SMILESCS(=O)(=O)NC(=O)c1ccccn1
InChIInChI=1S/C7H8N2O3S/c1-13(11,12)9-7(10)6-4-2-3-5-8-6/h2-5H,1H3,(H,9,10)
InChIKeyCQGGSIAZHQWWBM-UHFFFAOYSA-N
XLogP-0.23
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.22
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methylsulfonylpyridine-2-carboxamide?
The IUPAC name of N-methylsulfonylpyridine-2-carboxamide (CID 14952705) is N-methylsulfonylpyridine-2-carboxamide.
What is the SMILES notation for N-methylsulfonylpyridine-2-carboxamide?
The canonical SMILES for N-methylsulfonylpyridine-2-carboxamide is CS(=O)(=O)NC(=O)c1ccccn1.
What is the InChIKey of N-methylsulfonylpyridine-2-carboxamide?
The InChIKey is CQGGSIAZHQWWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3S/c1-13(11,12)9-7(10)6-4-2-3-5-8-6/h2-5H,1H3,(H,9,10).
What are the key properties of N-methylsulfonylpyridine-2-carboxamide?
N-methylsulfonylpyridine-2-carboxamide has a molecular weight of 200.22 g/mol, XLogP of -0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylsulfonylpyridine-2-carboxamide is sourced from PubChem (CID 14952705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).