2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide

C12H14N4O2S — CID 144630841

IUPAC2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCCOc1ccc(CC(=O)Nc2nnc(C)s2)nc1
InChIInChI=1S/C12H14N4O2S/c1-3-18-10-5-4-9(13-7-10)6-11(17)14-12-16-15-8(2)19-12/h4-5,7H,3,6H2,1-2H3,(H,14,16,17)
InChIKeyQTXSNMLWVHRVTQ-UHFFFAOYSA-N
MW278.34 g/mol
LogP1.82
Rot. Bonds5

About 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide

2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 144630841) has the molecular formula C12H14N4O2S and a molecular weight of 278.34 g/mol. Its IUPAC name is 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID144630841
Molecular FormulaC12H14N4O2S
Molecular Weight278.34 g/mol
Exact Mass278.08
IUPAC Name2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCCOc1ccc(CC(=O)Nc2nnc(C)s2)nc1
InChIInChI=1S/C12H14N4O2S/c1-3-18-10-5-4-9(13-7-10)6-11(17)14-12-16-15-8(2)19-12/h4-5,7H,3,6H2,1-2H3,(H,14,16,17)
InChIKeyQTXSNMLWVHRVTQ-UHFFFAOYSA-N
XLogP1.82
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide
CID 144928471
2-(2-bromo-4,5-diethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 16563035
3-(4-methylphenoxy)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
CID 35865418
2-(5-hydroxy-2-pyridinyl)-N-[5-[(1S,3S)-3-[5-[[2-[5-(2-methoxyethoxy)-2-pyridinyl]acetyl]amino]-1,3,4-thiadiazol-2-yl]cyclohexyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 135234046
2-(4-fluorophenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 808377
2-(3,4-dimethylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 18077203
2-(4-ethoxyphenyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)acetamide
CID 26209657
N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;molecular hydrogen
CID 162747394
N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 7541045
5-ethoxy-1-ethyl-3-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)indole-2-carboxamide
CID 110503961
4-ethoxy-N-[2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide
CID 34110789
4-(4-methoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
CID 49025371

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide (CID 144630841) is 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide is CCOc1ccc(CC(=O)Nc2nnc(C)s2)nc1.
What is the InChIKey of 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is QTXSNMLWVHRVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2S/c1-3-18-10-5-4-9(13-7-10)6-11(17)14-12-16-15-8(2)19-12/h4-5,7H,3,6H2,1-2H3,(H,14,16,17).
What are the key properties of 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 278.34 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 144630841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).