2,5-dimethyl-1,3,4-oxadiazole;propane

C7H14N2O — CID 143140950

IUPAC2,5-dimethyl-1,3,4-oxadiazole;propane
SMILESCCC.Cc1nnc(C)o1
InChIInChI=1S/C4H6N2O.C3H8/c1-3-5-6-4(2)7-3;1-3-2/h1-2H3;3H2,1-2H3
InChIKeyDVDOZCYFJCFIOC-UHFFFAOYSA-N
MW142.20 g/mol
LogP2.10
Rot. Bonds

About 2,5-dimethyl-1,3,4-oxadiazole;propane

2,5-dimethyl-1,3,4-oxadiazole;propane (PubChem CID 143140950) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 2,5-dimethyl-1,3,4-oxadiazole;propane.

Molecular Properties

Compound Name2,5-dimethyl-1,3,4-oxadiazole;propane
PubChem CID143140950
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name2,5-dimethyl-1,3,4-oxadiazole;propane
SMILESCCC.Cc1nnc(C)o1
InChIInChI=1S/C4H6N2O.C3H8/c1-3-5-6-4(2)7-3;1-3-2/h1-2H3;3H2,1-2H3
InChIKeyDVDOZCYFJCFIOC-UHFFFAOYSA-N
XLogP2.10
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,5-dimethyl-1,3,4-oxadiazole;propane 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-dimethyl-1,3,4-oxadiazole;propane?
The IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;propane (CID 143140950) is 2,5-dimethyl-1,3,4-oxadiazole;propane.
What is the SMILES notation for 2,5-dimethyl-1,3,4-oxadiazole;propane?
The canonical SMILES for 2,5-dimethyl-1,3,4-oxadiazole;propane is CCC.Cc1nnc(C)o1.
What is the InChIKey of 2,5-dimethyl-1,3,4-oxadiazole;propane?
The InChIKey is DVDOZCYFJCFIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O.C3H8/c1-3-5-6-4(2)7-3;1-3-2/h1-2H3;3H2,1-2H3.
What are the key properties of 2,5-dimethyl-1,3,4-oxadiazole;propane?
2,5-dimethyl-1,3,4-oxadiazole;propane has a molecular weight of 142.20 g/mol, XLogP of 2.10, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1,3,4-oxadiazole;propane is sourced from PubChem (CID 143140950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).