5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine

C5H9N3O2 — CID 55286084

IUPAC5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCCOc1nnc(NC)o1
InChIInChI=1S/C5H9N3O2/c1-3-9-5-8-7-4(6-2)10-5/h3H2,1-2H3,(H,6,7)
InChIKeyAYSIBJUHFLYNDT-UHFFFAOYSA-N
MW143.15 g/mol
LogP0.51
Rot. Bonds3

About 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine

5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine (PubChem CID 55286084) has the molecular formula C5H9N3O2 and a molecular weight of 143.15 g/mol. Its IUPAC name is 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine
PubChem CID55286084
Molecular FormulaC5H9N3O2
Molecular Weight143.15 g/mol
Exact Mass143.07
IUPAC Name5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCCOc1nnc(NC)o1
InChIInChI=1S/C5H9N3O2/c1-3-9-5-8-7-4(6-2)10-5/h3H2,1-2H3,(H,6,7)
InChIKeyAYSIBJUHFLYNDT-UHFFFAOYSA-N
XLogP0.51
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine (CID 55286084) is 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine is CCOc1nnc(NC)o1.
What is the InChIKey of 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine?
The InChIKey is AYSIBJUHFLYNDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2/c1-3-9-5-8-7-4(6-2)10-5/h3H2,1-2H3,(H,6,7).
What are the key properties of 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine?
5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine has a molecular weight of 143.15 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 5-ethoxy-N-methyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 55286084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).