3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide

C20H17N5O2 — CID 154837009

IUPAC3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide
SMILESO=C(CCc1nnc(-c2ccccc2)o1)NNc1ccc2ccccc2n1
InChIInChI=1S/C20H17N5O2/c26-18(23-22-17-11-10-14-6-4-5-9-16(14)21-17)12-13-19-24-25-20(27-19)15-7-2-1-3-8-15/h1-11H,12-13H2,(H,21,22)(H,23,26)
InChIKeyGDRKTXHYQQQCQW-UHFFFAOYSA-N
MW359.39 g/mol
LogP3.36
Rot. Bonds6

About 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide

3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide (PubChem CID 154837009) has the molecular formula C20H17N5O2 and a molecular weight of 359.39 g/mol. Its IUPAC name is 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide.

Molecular Properties

Compound Name3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide
PubChem CID154837009
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC Name3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide
SMILESO=C(CCc1nnc(-c2ccccc2)o1)NNc1ccc2ccccc2n1
InChIInChI=1S/C20H17N5O2/c26-18(23-22-17-11-10-14-6-4-5-9-16(14)21-17)12-13-19-24-25-20(27-19)15-7-2-1-3-8-15/h1-11H,12-13H2,(H,21,22)(H,23,26)
InChIKeyGDRKTXHYQQQCQW-UHFFFAOYSA-N
XLogP3.36
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide 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 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide?
The IUPAC name of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide (CID 154837009) is 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide.
What is the SMILES notation for 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide?
The canonical SMILES for 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide is O=C(CCc1nnc(-c2ccccc2)o1)NNc1ccc2ccccc2n1.
What is the InChIKey of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide?
The InChIKey is GDRKTXHYQQQCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c26-18(23-22-17-11-10-14-6-4-5-9-16(14)21-17)12-13-19-24-25-20(27-19)15-7-2-1-3-8-15/h1-11H,12-13H2,(H,21,22)(H,23,26).
What are the key properties of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide?
3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide has a molecular weight of 359.39 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N'-quinolin-2-ylpropanehydrazide is sourced from PubChem (CID 154837009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).