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

C12H13N3O2S — CID 4846708

IUPAC2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)/N=c1\sccn1C
InChIInChI=1S/C12H13N3O2S/c1-3-17-11-9(5-4-6-13-11)10(16)14-12-15(2)7-8-18-12/h4-8H,3H2,1-2H3/b14-12-
InChIKeyRZTNFHZTGTWLGT-OWBHPGMISA-N
MW263.32 g/mol
LogP1.62
Rot. Bonds3

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

2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide (PubChem CID 4846708) has the molecular formula C12H13N3O2S and a molecular weight of 263.32 g/mol. Its IUPAC name is 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide
PubChem CID4846708
Molecular FormulaC12H13N3O2S
Molecular Weight263.32 g/mol
Exact Mass263.07
IUPAC Name2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)/N=c1\sccn1C
InChIInChI=1S/C12H13N3O2S/c1-3-17-11-9(5-4-6-13-11)10(16)14-12-15(2)7-8-18-12/h4-8H,3H2,1-2H3/b14-12-
InChIKeyRZTNFHZTGTWLGT-OWBHPGMISA-N
XLogP1.62
TPSA56.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethoxy-N-(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 2464271
2-ethoxy-N-(3-phenylsulfanylpropyl)pyridine-3-carboxamide
CID 2517314
2-ethoxy-N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 2541702
N3,N3-dimethyl-6-(2,2,2-trifluoroethoxy)nicotinamide
CID 2727209
2-(2,2,2-Trifluoroethoxy)nicotinamide
CID 2727183
2-Phenoxynicotinamide
CID 2737121
1-[4-[[3-(2-Ethoxypyridine-3-carbonyl)-1,3-thiazinan-2-ylidene]amino]phenyl]ethanone
CID 2450544
Nicotinamide, N-amino-6-(2-diethylaminoethoxy)-
CID 205796
2-ethoxy-N-{3-[(2-ethoxy-3-pyridinyl)carbonyl]-1,3-thiazolan-2-yliden}nicotinamide
CID 1478062
2-Methoxypyridine-3-carboxamide
CID 252369
N-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethyl]-2-phenoxypyridine-3-carboxamide
CID 2797912
2-[(dimethylamino)methyl]2,3-dihydro-4-methylpyrido[3,2-f][1,4]oxazepin-5(4H)-one
CID 13689429

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide (CID 4846708) is 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide is CCOc1ncccc1C(=O)/N=c1\sccn1C.
What is the InChIKey of 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide?
The InChIKey is RZTNFHZTGTWLGT-OWBHPGMISA-N. The full InChI is InChI=1S/C12H13N3O2S/c1-3-17-11-9(5-4-6-13-11)10(16)14-12-15(2)7-8-18-12/h4-8H,3H2,1-2H3/b14-12-.
What are the key properties of 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide?
2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide has a molecular weight of 263.32 g/mol, XLogP of 1.62, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide is sourced from PubChem (CID 4846708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).