4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one

C15H16N4O4 — CID 167928447

IUPAC4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one
SMILESO=C1CC(c2nnc(-c3ccnc(OC4CCOC4)c3)o2)CN1
InChIInChI=1S/C15H16N4O4/c20-12-5-10(7-17-12)15-19-18-14(23-15)9-1-3-16-13(6-9)22-11-2-4-21-8-11/h1,3,6,10-11H,2,4-5,7-8H2,(H,17,20)
InChIKeyIXOOPISOVZSFFD-UHFFFAOYSA-N
MW316.32 g/mol
LogP0.90
Rot. Bonds4

About 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one

4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one (PubChem CID 167928447) has the molecular formula C15H16N4O4 and a molecular weight of 316.32 g/mol. Its IUPAC name is 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one
PubChem CID167928447
Molecular FormulaC15H16N4O4
Molecular Weight316.32 g/mol
Exact Mass316.12
IUPAC Name4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one
SMILESO=C1CC(c2nnc(-c3ccnc(OC4CCOC4)c3)o2)CN1
InChIInChI=1S/C15H16N4O4/c20-12-5-10(7-17-12)15-19-18-14(23-15)9-1-3-16-13(6-9)22-11-2-4-21-8-11/h1,3,6,10-11H,2,4-5,7-8H2,(H,17,20)
InChIKeyIXOOPISOVZSFFD-UHFFFAOYSA-N
XLogP0.90
TPSA99.37 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.32
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one with MolForge

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Related Compounds

2-(oxan-3-yl)-5-(2-phenoxy-4-pyridinyl)-1,3,4-oxadiazole
CID 167756386
2-(oxolan-3-yloxy)pyridine-4-carboxylic acid
CID 63559237
N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 75504581
N-[[2-(oxolan-3-yloxy)-4-pyridinyl]methyl]cyclopropanamine
CID 63558300
2-methyl-N-[[2-(oxolan-3-yloxy)-4-pyridinyl]methyl]propan-1-amine
CID 55212360
N-[2-[(3R)-oxolan-3-yl]oxy-4-pyridinyl]cyclobutanecarboxamide
CID 97329801
N-cyclododecyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 121160706
N-cyclohexyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815236
N-(2,3-dihydro-1H-inden-2-yl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 166214316
N-(2,6-difluorophenyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815300
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(3R)-oxolan-3-yl]oxypyridine-4-carboxamide
CID 124617694
4-(oxolan-3-yloxy)pyridine-2-carboxylic acid
CID 63556832

Frequently Asked Questions

What is the IUPAC name of 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one?
The IUPAC name of 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one (CID 167928447) is 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one.
What is the SMILES notation for 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one?
The canonical SMILES for 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one is O=C1CC(c2nnc(-c3ccnc(OC4CCOC4)c3)o2)CN1.
What is the InChIKey of 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one?
The InChIKey is IXOOPISOVZSFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O4/c20-12-5-10(7-17-12)15-19-18-14(23-15)9-1-3-16-13(6-9)22-11-2-4-21-8-11/h1,3,6,10-11H,2,4-5,7-8H2,(H,17,20).
What are the key properties of 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one?
4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one has a molecular weight of 316.32 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[2-(oxolan-3-yloxy)-4-pyridinyl]-1,3,4-oxadiazol-2-yl]pyrrolidin-2-one is sourced from PubChem (CID 167928447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).