5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide

C11H11N3O2S — CID 63858903

IUPAC5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide
SMILESCc1csc(CNC(=O)c2cncc(O)c2)n1
InChIInChI=1S/C11H11N3O2S/c1-7-6-17-10(14-7)5-13-11(16)8-2-9(15)4-12-3-8/h2-4,6,15H,5H2,1H3,(H,13,16)
InChIKeyPLIZVBYTUHYBRH-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.48
Rot. Bonds3

About 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide

5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 63858903) has the molecular formula C11H11N3O2S and a molecular weight of 249.30 g/mol. Its IUPAC name is 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide
PubChem CID63858903
Molecular FormulaC11H11N3O2S
Molecular Weight249.30 g/mol
Exact Mass249.06
IUPAC Name5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide
SMILESCc1csc(CNC(=O)c2cncc(O)c2)n1
InChIInChI=1S/C11H11N3O2S/c1-7-6-17-10(14-7)5-13-11(16)8-2-9(15)4-12-3-8/h2-4,6,15H,5H2,1H3,(H,13,16)
InChIKeyPLIZVBYTUHYBRH-UHFFFAOYSA-N
XLogP1.48
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 60709490
5-hydroxy-N-(1,3-thiazol-2-ylmethyl)pyridine-3-carboxamide
CID 63858732
3-hydroxy-4-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 60709417
2-[[(5-hydroxypyridine-3-carbonyl)amino]methyl]-4-methyl-1,3-thiazole-5-carboxylic acid
CID 63851851
N-[(4-bromothiophen-2-yl)methyl]-5-hydroxypyridine-3-carboxamide
CID 63930382
N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrazine-2-carboxamide
CID 43040329
N-[(4,5-dimethylthiophen-2-yl)methyl]-5-hydroxypyridine-3-carboxamide
CID 65244137
5-[(4-methyl-1,3-thiazol-2-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 60725191
4,5-dibromo-N-[(4-methyl-1,3-thiazol-2-yl)methyl]thiophene-2-carboxamide
CID 51291417
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 51291464
5-ethyl-4-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]thiophene-2-carboxamide
CID 47138313
2-hydrazinyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-4-carboxamide
CID 62247850

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide (CID 63858903) is 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide is Cc1csc(CNC(=O)c2cncc(O)c2)n1.
What is the InChIKey of 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is PLIZVBYTUHYBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S/c1-7-6-17-10(14-7)5-13-11(16)8-2-9(15)4-12-3-8/h2-4,6,15H,5H2,1H3,(H,13,16).
What are the key properties of 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide?
5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 249.30 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 63858903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).