(4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one

C6H7N3O2 — CID 129498729

IUPAC(4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one
SMILESO=C1C[C@H](c2nnco2)CN1
InChIInChI=1S/C6H7N3O2/c10-5-1-4(2-7-5)6-9-8-3-11-6/h3-4H,1-2H2,(H,7,10)/t4-/m0/s1
InChIKeyGOCIVSLGYNZJLZ-BYPYZUCNSA-N
MW153.14 g/mol
LogP-0.33
Rot. Bonds1

About (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one

(4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one (PubChem CID 129498729) has the molecular formula C6H7N3O2 and a molecular weight of 153.14 g/mol. Its IUPAC name is (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one
PubChem CID129498729
Molecular FormulaC6H7N3O2
Molecular Weight153.14 g/mol
Exact Mass153.05
IUPAC Name(4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one
SMILESO=C1C[C@H](c2nnco2)CN1
InChIInChI=1S/C6H7N3O2/c10-5-1-4(2-7-5)6-9-8-3-11-6/h3-4H,1-2H2,(H,7,10)/t4-/m0/s1
InChIKeyGOCIVSLGYNZJLZ-BYPYZUCNSA-N
XLogP-0.33
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyrrolidin-3-yl-1,3,4-oxadiazole;dihydrochloride
CID 162343207
(4R)-4-(furan-2-yl)pyrrolidin-2-one
CID 94826830
2-(azepan-4-yl)-1,3,4-oxadiazole
CID 84652759
4-pyridin-2-ylpyrrolidin-2-one
CID 47002994
4-(4-cyclopropylphenyl)pyrrolidin-2-one
CID 79978170
4-[3-(2-aminoethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one
CID 117058529
(4S)-4-(3-methylimidazol-4-yl)pyrrolidin-2-one
CID 97031037
4-phenylpyrrolidin-2-one;hydrate
CID 171699854
4-(1-propan-2-yltriazol-4-yl)pyrrolidin-2-one
CID 130549123
4-(5-bromo-3-pyridinyl)pyrrolidin-2-one
CID 102567776
(4S)-4-(5-amino-2-pyridinyl)pyrrolidin-2-one
CID 124634642
4-(2-methyl-1,3-thiazol-5-yl)pyrrolidin-2-one
CID 130580485

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one?
The IUPAC name of (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one (CID 129498729) is (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one.
What is the SMILES notation for (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one?
The canonical SMILES for (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one is O=C1C[C@H](c2nnco2)CN1.
What is the InChIKey of (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one?
The InChIKey is GOCIVSLGYNZJLZ-BYPYZUCNSA-N. The full InChI is InChI=1S/C6H7N3O2/c10-5-1-4(2-7-5)6-9-8-3-11-6/h3-4H,1-2H2,(H,7,10)/t4-/m0/s1.
What are the key properties of (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one?
(4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one has a molecular weight of 153.14 g/mol, XLogP of -0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(1,3,4-oxadiazol-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 129498729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).