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

C14H13N3O4S — CID 146154862

IUPACN-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide
SMILESCS(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H13N3O4S/c1-22(20,21)17-13(18)10-5-7-11(8-6-10)16-14(19)12-4-2-3-9-15-12/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyRNDGVNRUFUCEOB-UHFFFAOYSA-N
MW319.34 g/mol
LogP1.02
Rot. Bonds4

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

N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide (PubChem CID 146154862) has the molecular formula C14H13N3O4S and a molecular weight of 319.34 g/mol. Its IUPAC name is N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide
PubChem CID146154862
Molecular FormulaC14H13N3O4S
Molecular Weight319.34 g/mol
Exact Mass319.06
IUPAC NameN-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide
SMILESCS(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H13N3O4S/c1-22(20,21)17-13(18)10-5-7-11(8-6-10)16-14(19)12-4-2-3-9-15-12/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyRNDGVNRUFUCEOB-UHFFFAOYSA-N
XLogP1.02
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 ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methylsulfonylpyridine-2-carboxamide
CID 14952705
4-(pyridine-2-carbonylamino)benzoic acid
CID 16770258
N-(4-benzoylphenyl)pyridine-2-carboxamide
CID 157248993
N-[2-[[4-(methanesulfonamido)benzoyl]amino]ethyl]pyridine-2-carboxamide
CID 108540814
N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 821516
dichloromanganese;bis(N-(4-methylphenyl)pyridine-2-carboxamide)
CID 11455628
4-(methanesulfonamido)-N-pyridin-2-ylbenzamide
CID 42113789
propyl 4-(pyridine-2-carbonylamino)benzoate
CID 17353106
N-(4-pyridin-2-ylphenyl)pyridine-2-carboxamide
CID 110461625
N-[1-[4-[(4-chlorobenzoyl)amino]phenyl]ethylideneamino]pyridine-2-carboxamide
CID 5158930
N-[4-[(4-piperidin-1-ylphenyl)carbamoyl]phenyl]pyridine-2-carboxamide
CID 46489538
N-[4-(ethylaminomethyl)phenyl]pyridine-2-carboxamide
CID 106910172

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide (CID 146154862) is N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide is CS(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccccn2)cc1.
What is the InChIKey of N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide?
The InChIKey is RNDGVNRUFUCEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O4S/c1-22(20,21)17-13(18)10-5-7-11(8-6-10)16-14(19)12-4-2-3-9-15-12/h2-9H,1H3,(H,16,19)(H,17,18).
What are the key properties of N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide?
N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide has a molecular weight of 319.34 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylsulfonylcarbamoyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 146154862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).