4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine

C8H15N5O — CID 118964286

IUPAC4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine
SMILESCCc1nnc(N2CCN(N)CC2)o1
InChIInChI=1S/C8H15N5O/c1-2-7-10-11-8(14-7)12-3-5-13(9)6-4-12/h2-6,9H2,1H3
InChIKeyQLSNVNAKXHMWJE-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.37
Rot. Bonds2

About 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine

4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine (PubChem CID 118964286) has the molecular formula C8H15N5O and a molecular weight of 197.24 g/mol. Its IUPAC name is 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine.

Molecular Properties

Compound Name4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine
PubChem CID118964286
Molecular FormulaC8H15N5O
Molecular Weight197.24 g/mol
Exact Mass197.13
IUPAC Name4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine
SMILESCCc1nnc(N2CCN(N)CC2)o1
InChIInChI=1S/C8H15N5O/c1-2-7-10-11-8(14-7)12-3-5-13(9)6-4-12/h2-6,9H2,1H3
InChIKeyQLSNVNAKXHMWJE-UHFFFAOYSA-N
XLogP-0.37
TPSA71.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

Analyze 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine 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 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine?
The IUPAC name of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine (CID 118964286) is 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine.
What is the SMILES notation for 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine?
The canonical SMILES for 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine is CCc1nnc(N2CCN(N)CC2)o1.
What is the InChIKey of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine?
The InChIKey is QLSNVNAKXHMWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O/c1-2-7-10-11-8(14-7)12-3-5-13(9)6-4-12/h2-6,9H2,1H3.
What are the key properties of 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine?
4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine has a molecular weight of 197.24 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-ethyl-1,3,4-oxadiazol-2-yl)piperazin-1-amine is sourced from PubChem (CID 118964286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).