N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide

C8H11N3O3 — CID 64591903

IUPACN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C8H11N3O3/c1-13-4-6(12)9-8-11-10-7(14-8)5-2-3-5/h5H,2-4H2,1H3,(H,9,11,12)
InChIKeyFCNQBTZJMNWCFV-UHFFFAOYSA-N
MW197.19 g/mol
LogP0.53
Rot. Bonds4

About N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide

N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide (PubChem CID 64591903) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide
PubChem CID64591903
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C8H11N3O3/c1-13-4-6(12)9-8-11-10-7(14-8)5-2-3-5/h5H,2-4H2,1H3,(H,9,11,12)
InChIKeyFCNQBTZJMNWCFV-UHFFFAOYSA-N
XLogP0.53
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide (CID 64591903) is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide is COCC(=O)Nc1nnc(C2CC2)o1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide?
The InChIKey is FCNQBTZJMNWCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1-13-4-6(12)9-8-11-10-7(14-8)5-2-3-5/h5H,2-4H2,1H3,(H,9,11,12).
What are the key properties of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide?
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide has a molecular weight of 197.19 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide is sourced from PubChem (CID 64591903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).