2-methoxy-N-(thiadiazol-4-yl)propanamide

C6H9N3O2S — CID 130683606

IUPAC2-methoxy-N-(thiadiazol-4-yl)propanamide
SMILESCOC(C)C(=O)Nc1csnn1
InChIInChI=1S/C6H9N3O2S/c1-4(11-2)6(10)7-5-3-12-9-8-5/h3-4H,1-2H3,(H,7,10)
InChIKeyVIASHUWSNIBOGK-UHFFFAOYSA-N
MW187.22 g/mol
LogP0.51
Rot. Bonds3

About 2-methoxy-N-(thiadiazol-4-yl)propanamide

2-methoxy-N-(thiadiazol-4-yl)propanamide (PubChem CID 130683606) has the molecular formula C6H9N3O2S and a molecular weight of 187.22 g/mol. Its IUPAC name is 2-methoxy-N-(thiadiazol-4-yl)propanamide.

Molecular Properties

Compound Name2-methoxy-N-(thiadiazol-4-yl)propanamide
PubChem CID130683606
Molecular FormulaC6H9N3O2S
Molecular Weight187.22 g/mol
Exact Mass187.04
IUPAC Name2-methoxy-N-(thiadiazol-4-yl)propanamide
SMILESCOC(C)C(=O)Nc1csnn1
InChIInChI=1S/C6H9N3O2S/c1-4(11-2)6(10)7-5-3-12-9-8-5/h3-4H,1-2H3,(H,7,10)
InChIKeyVIASHUWSNIBOGK-UHFFFAOYSA-N
XLogP0.51
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(thiadiazol-4-yl)propanamide?
The IUPAC name of 2-methoxy-N-(thiadiazol-4-yl)propanamide (CID 130683606) is 2-methoxy-N-(thiadiazol-4-yl)propanamide.
What is the SMILES notation for 2-methoxy-N-(thiadiazol-4-yl)propanamide?
The canonical SMILES for 2-methoxy-N-(thiadiazol-4-yl)propanamide is COC(C)C(=O)Nc1csnn1.
What is the InChIKey of 2-methoxy-N-(thiadiazol-4-yl)propanamide?
The InChIKey is VIASHUWSNIBOGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S/c1-4(11-2)6(10)7-5-3-12-9-8-5/h3-4H,1-2H3,(H,7,10).
What are the key properties of 2-methoxy-N-(thiadiazol-4-yl)propanamide?
2-methoxy-N-(thiadiazol-4-yl)propanamide has a molecular weight of 187.22 g/mol, XLogP of 0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(thiadiazol-4-yl)propanamide is sourced from PubChem (CID 130683606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).