5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide

C9H12N2O4S — CID 63866364

IUPAC5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide
SMILESCS(=O)(=O)CCNC(=O)c1cncc(O)c1
InChIInChI=1S/C9H12N2O4S/c1-16(14,15)3-2-11-9(13)7-4-8(12)6-10-5-7/h4-6,12H,2-3H2,1H3,(H,11,13)
InChIKeyJNWCNECUVGPBRE-UHFFFAOYSA-N
MW244.27 g/mol
LogP-0.44
Rot. Bonds4

About 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide

5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide (PubChem CID 63866364) has the molecular formula C9H12N2O4S and a molecular weight of 244.27 g/mol. Its IUPAC name is 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide
PubChem CID63866364
Molecular FormulaC9H12N2O4S
Molecular Weight244.27 g/mol
Exact Mass244.05
IUPAC Name5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide
SMILESCS(=O)(=O)CCNC(=O)c1cncc(O)c1
InChIInChI=1S/C9H12N2O4S/c1-16(14,15)3-2-11-9(13)7-4-8(12)6-10-5-7/h4-6,12H,2-3H2,1H3,(H,11,13)
InChIKeyJNWCNECUVGPBRE-UHFFFAOYSA-N
XLogP-0.44
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-hydroxy-N-[5-[(5-hydroxypyridine-3-carbonyl)amino]pentyl]pyridine-3-carboxamide
CID 3309734
N-(2-acetamidoethyl)-5-hydroxypyridine-3-carboxamide;ethane
CID 143571890
5-hydroxy-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 63865493
N-(2-ethylsulfinylethyl)-5-hydroxypyridine-3-carboxamide
CID 115633331
N-(2,2-dimethylpropyl)-5-hydroxypyridine-3-carboxamide
CID 63866542
2-[(5-hydroxypyridine-3-carbonyl)amino]acetic acid
CID 770223
5-hydroxy-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 63860872
N-[(4,5-dimethylthiophen-2-yl)methyl]-5-hydroxypyridine-3-carboxamide
CID 65244137
5-hydroxy-N-(3-piperidin-1-ylpropyl)pyridine-3-carboxamide
CID 55258279
3,5-dichloro-N-(2-methylsulfonylethyl)benzamide
CID 47230479
N-(2-cyclopentylethyl)-5-hydroxypyridine-3-carboxamide
CID 63866200
5-hydroxy-N-[2-[2-methoxyethyl(methyl)amino]ethyl]pyridine-3-carboxamide
CID 63859816

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide (CID 63866364) is 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide is CS(=O)(=O)CCNC(=O)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide?
The InChIKey is JNWCNECUVGPBRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4S/c1-16(14,15)3-2-11-9(13)7-4-8(12)6-10-5-7/h4-6,12H,2-3H2,1H3,(H,11,13).
What are the key properties of 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide?
5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide has a molecular weight of 244.27 g/mol, XLogP of -0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-(2-methylsulfonylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 63866364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).