5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one

C15H19N5O3 — CID 110610852

IUPAC5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one
SMILESCC(C)c1nnc(N2CCN(C(=O)c3ccc(=O)[nH]c3)CC2)o1
InChIInChI=1S/C15H19N5O3/c1-10(2)13-17-18-15(23-13)20-7-5-19(6-8-20)14(22)11-3-4-12(21)16-9-11/h3-4,9-10H,5-8H2,1-2H3,(H,16,21)
InChIKeyOPDJHLMLJMHYOC-UHFFFAOYSA-N
MW317.35 g/mol
LogP0.84
Rot. Bonds3

About 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one

5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 110610852) has the molecular formula C15H19N5O3 and a molecular weight of 317.35 g/mol. Its IUPAC name is 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one
PubChem CID110610852
Molecular FormulaC15H19N5O3
Molecular Weight317.35 g/mol
Exact Mass317.15
IUPAC Name5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one
SMILESCC(C)c1nnc(N2CCN(C(=O)c3ccc(=O)[nH]c3)CC2)o1
InChIInChI=1S/C15H19N5O3/c1-10(2)13-17-18-15(23-13)20-7-5-19(6-8-20)14(22)11-3-4-12(21)16-9-11/h3-4,9-10H,5-8H2,1-2H3,(H,16,21)
InChIKeyOPDJHLMLJMHYOC-UHFFFAOYSA-N
XLogP0.84
TPSA95.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one with MolForge

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Launch Full Analysis

Related Compounds

(3-bromophenyl)-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]methanone
CID 110603131
2-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]propanoic acid
CID 62317762
(5-phenyl-1,2-oxazol-3-yl)-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]methanone
CID 110619764
5-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
CID 4826168
1-(4-chlorophenyl)-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]butane-1,4-dione
CID 110417422
3-[4-(5-methyl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridazin-6-one
CID 110665089
5-[4-(5-chloropyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one
CID 86783720
5-[4-[2-(2-methylpropylsulfanyl)acetyl]piperazine-1-carbonyl]-1H-pyridin-2-one
CID 84583610
5-(4-cyclopropylpiperazine-1-carbonyl)-1H-pyridin-2-one
CID 47268320
2-(4-chlorophenyl)-1-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]ethanone
CID 110603136
N-ethyl-4-(6-oxo-1H-pyridine-3-carbonyl)piperazine-1-carboxamide
CID 60701290
(4-methyl-2-phenyl-1,3-thiazol-5-yl)-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]methanone
CID 110417362

Frequently Asked Questions

What is the IUPAC name of 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one (CID 110610852) is 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one is CC(C)c1nnc(N2CCN(C(=O)c3ccc(=O)[nH]c3)CC2)o1.
What is the InChIKey of 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is OPDJHLMLJMHYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3/c1-10(2)13-17-18-15(23-13)20-7-5-19(6-8-20)14(22)11-3-4-12(21)16-9-11/h3-4,9-10H,5-8H2,1-2H3,(H,16,21).
What are the key properties of 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one?
5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 317.35 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)piperazine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 110610852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).