2,5-dipropyl-1,3,4-oxadiazole

C8H14N2O — CID 15130212

IUPAC2,5-dipropyl-1,3,4-oxadiazole
SMILESCCCc1nnc(CCC)o1
InChIInChI=1S/C8H14N2O/c1-3-5-7-9-10-8(11-7)6-4-2/h3-6H2,1-2H3
InChIKeyWDMXAXPNGIHVSU-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.97
Rot. Bonds4

About 2,5-dipropyl-1,3,4-oxadiazole

2,5-dipropyl-1,3,4-oxadiazole (PubChem CID 15130212) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2,5-dipropyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2,5-dipropyl-1,3,4-oxadiazole
PubChem CID15130212
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2,5-dipropyl-1,3,4-oxadiazole
SMILESCCCc1nnc(CCC)o1
InChIInChI=1S/C8H14N2O/c1-3-5-7-9-10-8(11-7)6-4-2/h3-6H2,1-2H3
InChIKeyWDMXAXPNGIHVSU-UHFFFAOYSA-N
XLogP1.97
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,5-dipropyl-1,3,4-oxadiazole 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 2,5-dipropyl-1,3,4-oxadiazole?
The IUPAC name of 2,5-dipropyl-1,3,4-oxadiazole (CID 15130212) is 2,5-dipropyl-1,3,4-oxadiazole.
What is the SMILES notation for 2,5-dipropyl-1,3,4-oxadiazole?
The canonical SMILES for 2,5-dipropyl-1,3,4-oxadiazole is CCCc1nnc(CCC)o1.
What is the InChIKey of 2,5-dipropyl-1,3,4-oxadiazole?
The InChIKey is WDMXAXPNGIHVSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-3-5-7-9-10-8(11-7)6-4-2/h3-6H2,1-2H3.
What are the key properties of 2,5-dipropyl-1,3,4-oxadiazole?
2,5-dipropyl-1,3,4-oxadiazole has a molecular weight of 154.21 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dipropyl-1,3,4-oxadiazole is sourced from PubChem (CID 15130212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).