2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide

C11H12N4O2S — CID 647177

IUPAC2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCOCC(=O)N(C)c1nnc(-c2ccccn2)s1
InChIInChI=1S/C11H12N4O2S/c1-15(9(16)7-17-2)11-14-13-10(18-11)8-5-3-4-6-12-8/h3-6H,7H2,1-2H3
InChIKeyHKWIHROBVWKWMR-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.21
Rot. Bonds4

About 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide

2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 647177) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID647177
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Name2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCOCC(=O)N(C)c1nnc(-c2ccccn2)s1
InChIInChI=1S/C11H12N4O2S/c1-15(9(16)7-17-2)11-14-13-10(18-11)8-5-3-4-6-12-8/h3-6H,7H2,1-2H3
InChIKeyHKWIHROBVWKWMR-UHFFFAOYSA-N
XLogP1.21
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-methoxy-N-methyl-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 1447039
N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
CID 654941
(2R)-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)oxolane-2-carboxamide
CID 1446968
N-methyl-5-pyridin-2-yl-N-(2-pyridin-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 133466920
N-(2-bromophenyl)-2-[methyl-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)amino]acetamide
CID 133467116
[2-(N-methylanilino)-2-oxoethyl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate
CID 9137078
5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide
CID 159760576
2-(2-methoxyethylamino)-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 119855748
N-[(2,3-dichlorophenyl)methyl]-N-methyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
CID 133467107
N-ethyl-N-(2-methylprop-2-enyl)-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
CID 133467966
N-[(4-bromophenyl)methyl]-N-methyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
CID 133467109
(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol
CID 58504238

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide (CID 647177) is 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide is COCC(=O)N(C)c1nnc(-c2ccccn2)s1.
What is the InChIKey of 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is HKWIHROBVWKWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-15(9(16)7-17-2)11-14-13-10(18-11)8-5-3-4-6-12-8/h3-6H,7H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 264.31 g/mol, XLogP of 1.21, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 647177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).