2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole

C16H16N6O — CID 95931465

IUPAC2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole
SMILESc1ccc(N2CCN(c3nnc(-c4cnccn4)o3)CC2)cc1
InChIInChI=1S/C16H16N6O/c1-2-4-13(5-3-1)21-8-10-22(11-9-21)16-20-19-15(23-16)14-12-17-6-7-18-14/h1-7,12H,8-11H2
InChIKeyAISJMECVLUIAAP-UHFFFAOYSA-N
MW308.35 g/mol
LogP1.85
Rot. Bonds3

About 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole

2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole (PubChem CID 95931465) has the molecular formula C16H16N6O and a molecular weight of 308.35 g/mol. Its IUPAC name is 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole
PubChem CID95931465
Molecular FormulaC16H16N6O
Molecular Weight308.35 g/mol
Exact Mass308.14
IUPAC Name2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole
SMILESc1ccc(N2CCN(c3nnc(-c4cnccn4)o3)CC2)cc1
InChIInChI=1S/C16H16N6O/c1-2-4-13(5-3-1)21-8-10-22(11-9-21)16-20-19-15(23-16)14-12-17-6-7-18-14/h1-7,12H,8-11H2
InChIKeyAISJMECVLUIAAP-UHFFFAOYSA-N
XLogP1.85
TPSA71.18 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.35
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-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

Related Compounds

3-[5-(4-phenylpiperazin-1-yl)-1,3,4-oxadiazol-2-yl]aniline
CID 28720299
N-[(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)methyl]-3-pyrrolidin-1-ylbenzamide
CID 92568978
2-(4-piperidin-1-ylphenyl)pyrazine
CID 90697442
2-cyclopropyl-5-(4-pyridin-3-ylpiperazin-1-yl)-1,3,4-oxadiazole
CID 72898587
2-[(3R)-1-[(2-chlorophenyl)methyl]piperidin-3-yl]-5-pyrazin-2-yl-1,3,4-oxadiazole
CID 92572835
2-piperidin-1-yl-5-pyridin-4-yl-1,3,4-oxadiazole
CID 86112469
2-(2-piperidin-1-ylphenyl)pyrazine
CID 134967164
2-[(2R)-1-[(2,3-difluorophenyl)methyl]piperidin-2-yl]-5-pyrazin-2-yl-1,3,4-oxadiazole
CID 125023353
2-[(4R)-4-(4-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-5-pyrazin-2-yl-1,3,4-oxadiazole
CID 169166041
2-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-5-pyrazin-2-yl-1,3,4-oxadiazole
CID 92601774
3-[5-(azetidin-1-yl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine
CID 10680278
2-[(4S)-4-(4-propan-2-ylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-5-pyrazin-2-yl-1,3,4-oxadiazole
CID 169165231

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole?
The IUPAC name of 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole (CID 95931465) is 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole is c1ccc(N2CCN(c3nnc(-c4cnccn4)o3)CC2)cc1.
What is the InChIKey of 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole?
The InChIKey is AISJMECVLUIAAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N6O/c1-2-4-13(5-3-1)21-8-10-22(11-9-21)16-20-19-15(23-16)14-12-17-6-7-18-14/h1-7,12H,8-11H2.
What are the key properties of 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole?
2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole has a molecular weight of 308.35 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylpiperazin-1-yl)-5-pyrazin-2-yl-1,3,4-oxadiazole is sourced from PubChem (CID 95931465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).