3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide

C10H14N2O4S — CID 80707419

IUPAC3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide
SMILESCN(CCS(C)(=O)=O)C(=O)c1ccncc1O
InChIInChI=1S/C10H14N2O4S/c1-12(5-6-17(2,15)16)10(14)8-3-4-11-7-9(8)13/h3-4,7,13H,5-6H2,1-2H3
InChIKeyNLBDGGYKVIFSON-UHFFFAOYSA-N
MW258.30 g/mol
LogP-0.10
Rot. Bonds4

About 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide

3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide (PubChem CID 80707419) has the molecular formula C10H14N2O4S and a molecular weight of 258.30 g/mol. Its IUPAC name is 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide
PubChem CID80707419
Molecular FormulaC10H14N2O4S
Molecular Weight258.30 g/mol
Exact Mass258.07
IUPAC Name3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide
SMILESCN(CCS(C)(=O)=O)C(=O)c1ccncc1O
InChIInChI=1S/C10H14N2O4S/c1-12(5-6-17(2,15)16)10(14)8-3-4-11-7-9(8)13/h3-4,7,13H,5-6H2,1-2H3
InChIKeyNLBDGGYKVIFSON-UHFFFAOYSA-N
XLogP-0.10
TPSA87.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)pyridine-3-carboxamide
CID 81249905
tris(3-hydroxy-N-(2-methoxyethyl)-N-methylpyridine-4-carboxamide);iron(3+)
CID 161269738
3-hydroxy-N-methyl-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 80706848
2-amino-5-hydroxy-N-methyl-N-(2-methylsulfonylethyl)benzamide
CID 107075641
3-[methyl(2-methylsulfonylethyl)amino]pyridine-4-carboxylic acid
CID 114288792
3-amino-N,2-dimethyl-N-(2-methylsulfonylethyl)benzamide
CID 79842599
N-(cyclohexylmethyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 80707237
2-chloro-N-methyl-N-(2-methylsulfonylethyl)-3-nitropyridine-4-carboxamide
CID 79208594
N-[2-(cyclopropylamino)-2-oxoethyl]-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81443007
N-tert-butyl-3-fluoro-N-(2-methylsulfonylethyl)pyridine-4-carboxamide
CID 86800886
N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81446196
5-amino-N,2-dimethyl-N-(2-methylsulfonylethyl)benzamide;hydrochloride
CID 120622618

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide (CID 80707419) is 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide is CN(CCS(C)(=O)=O)C(=O)c1ccncc1O.
What is the InChIKey of 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide?
The InChIKey is NLBDGGYKVIFSON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S/c1-12(5-6-17(2,15)16)10(14)8-3-4-11-7-9(8)13/h3-4,7,13H,5-6H2,1-2H3.
What are the key properties of 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide?
3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide has a molecular weight of 258.30 g/mol, XLogP of -0.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-methyl-N-(2-methylsulfonylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 80707419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).