1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol

C7H13N3O2 — CID 130151693

IUPAC1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol
SMILESCCc1nnc(C(N)C(C)O)o1
InChIInChI=1S/C7H13N3O2/c1-3-5-9-10-7(12-5)6(8)4(2)11/h4,6,11H,3,8H2,1-2H3
InChIKeyLGYUZLVAIGFWJJ-UHFFFAOYSA-N
MW171.20 g/mol
LogP0.01
Rot. Bonds3

About 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol

1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol (PubChem CID 130151693) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol
PubChem CID130151693
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC Name1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol
SMILESCCc1nnc(C(N)C(C)O)o1
InChIInChI=1S/C7H13N3O2/c1-3-5-9-10-7(12-5)6(8)4(2)11/h4,6,11H,3,8H2,1-2H3
InChIKeyLGYUZLVAIGFWJJ-UHFFFAOYSA-N
XLogP0.01
TPSA85.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol?
The IUPAC name of 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol (CID 130151693) is 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol.
What is the SMILES notation for 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol?
The canonical SMILES for 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol is CCc1nnc(C(N)C(C)O)o1.
What is the InChIKey of 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol?
The InChIKey is LGYUZLVAIGFWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c1-3-5-9-10-7(12-5)6(8)4(2)11/h4,6,11H,3,8H2,1-2H3.
What are the key properties of 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol?
1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol has a molecular weight of 171.20 g/mol, XLogP of 0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-1-(5-ethyl-1,3,4-oxadiazol-2-yl)propan-2-ol is sourced from PubChem (CID 130151693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).