2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide

C10H9N3OS — CID 176827176

IUPAC2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Cc1cscn1
InChIInChI=1S/C10H9N3OS/c11-10(14)8-2-1-3-12-9(8)4-7-5-15-6-13-7/h1-3,5-6H,4H2,(H2,11,14)
InChIKeyZTBDBGLBTRRHFU-UHFFFAOYSA-N
MW219.27 g/mol
LogP1.23
Rot. Bonds3

About 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide

2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 176827176) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
PubChem CID176827176
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC Name2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Cc1cscn1
InChIInChI=1S/C10H9N3OS/c11-10(14)8-2-1-3-12-9(8)4-7-5-15-6-13-7/h1-3,5-6H,4H2,(H2,11,14)
InChIKeyZTBDBGLBTRRHFU-UHFFFAOYSA-N
XLogP1.23
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
CID 142681726
2-benzylpyridine-3-carboxamide;dihydrochloride
CID 141007334
2-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]pyridine-3-carboxamide
CID 140674326
2-[(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide
CID 66848170
3-amino-2-[methyl(1,3-thiazol-4-ylmethyl)amino]benzamide
CID 112578626
2-[(3,4-dimethoxyphenyl)methyl]pyridine-3-carboxamide
CID 66964231
2-(1,3-thiazol-4-yl)benzamide
CID 140649331
2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide
CID 172813947
ethyl 2-(1,3-thiazol-4-ylmethylamino)pyridine-3-carboxylate
CID 63831190
1,3-thiazol-4-ylmethyl acetate
CID 45117618
2-[(3-carbamoyl-2-pyridinyl)sulfanyl]pyridine-3-carboxylic acid
CID 24694206
2-amino-5-(1,3-thiazol-4-ylmethylamino)benzamide
CID 63825784

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide (CID 176827176) is 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide is NC(=O)c1cccnc1Cc1cscn1.
What is the InChIKey of 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is ZTBDBGLBTRRHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c11-10(14)8-2-1-3-12-9(8)4-7-5-15-6-13-7/h1-3,5-6H,4H2,(H2,11,14).
What are the key properties of 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide?
2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 219.27 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 176827176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).