2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide

C12H13N3O2S — CID 2091502

IUPAC2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1ncc(C)s1
InChIInChI=1S/C12H13N3O2S/c1-3-17-11-9(5-4-6-13-11)10(16)15-12-14-7-8(2)18-12/h4-7H,3H2,1-2H3,(H,14,15,16)
InChIKeyPTDLDMXOZGCGOC-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.50
Rot. Bonds4

About 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide

2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 2091502) has the molecular formula C12H13N3O2S and a molecular weight of 263.32 g/mol. Its IUPAC name is 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID2091502
Molecular FormulaC12H13N3O2S
Molecular Weight263.32 g/mol
Exact Mass263.07
IUPAC Name2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1ncc(C)s1
InChIInChI=1S/C12H13N3O2S/c1-3-17-11-9(5-4-6-13-11)10(16)15-12-14-7-8(2)18-12/h4-7H,3H2,1-2H3,(H,14,15,16)
InChIKeyPTDLDMXOZGCGOC-UHFFFAOYSA-N
XLogP2.50
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-ethoxypyridine-3-carboxamide
CID 2378817
2-ethoxy-N-(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 2464271
2-ethoxy-N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 2541702
2-ethoxy-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 2114513
Ethyl 4-methyl-2-(pyridine-3-amido)-1,3-thiazole-5-carboxylate
CID 4124935
2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 2442210
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-ethoxypyridine-3-carboxamide
CID 2450368
2-ethoxy-N-(5-methylpyridin-2-yl)pyridine-3-carboxamide
CID 18106791
2-ethoxy-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyridine-3-carboxamide
CID 2161641
US11306081, Example 088
CID 156361539
US11306081, Example 098
CID 156381280
N-[4-(1-aminoethyl)-1,3-thiazol-2-yl]-2-phenoxypyridine-3-carboxamide
CID 155558865

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 2091502) is 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide is CCOc1ncccc1C(=O)Nc1ncc(C)s1.
What is the InChIKey of 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is PTDLDMXOZGCGOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2S/c1-3-17-11-9(5-4-6-13-11)10(16)15-12-14-7-8(2)18-12/h4-7H,3H2,1-2H3,(H,14,15,16).
What are the key properties of 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 263.32 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 2091502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).