oxadiazole;piperidin-2-one

C7H11N3O2 — CID 157148463

IUPACoxadiazole;piperidin-2-one
SMILESO=C1CCCCN1.c1conn1
InChIInChI=1S/C5H9NO.C2H2N2O/c7-5-3-1-2-4-6-5;1-2-5-4-3-1/h1-4H2,(H,6,7);1-2H
InChIKeyAKZDAUCMQWYPAF-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.36
Rot. Bonds

About oxadiazole;piperidin-2-one

oxadiazole;piperidin-2-one (PubChem CID 157148463) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is oxadiazole;piperidin-2-one.

Molecular Properties

Compound Nameoxadiazole;piperidin-2-one
PubChem CID157148463
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Nameoxadiazole;piperidin-2-one
SMILESO=C1CCCCN1.c1conn1
InChIInChI=1S/C5H9NO.C2H2N2O/c7-5-3-1-2-4-6-5;1-2-5-4-3-1/h1-4H2,(H,6,7);1-2H
InChIKeyAKZDAUCMQWYPAF-UHFFFAOYSA-N
XLogP0.36
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of oxadiazole;piperidin-2-one?
The IUPAC name of oxadiazole;piperidin-2-one (CID 157148463) is oxadiazole;piperidin-2-one.
What is the SMILES notation for oxadiazole;piperidin-2-one?
The canonical SMILES for oxadiazole;piperidin-2-one is O=C1CCCCN1.c1conn1.
What is the InChIKey of oxadiazole;piperidin-2-one?
The InChIKey is AKZDAUCMQWYPAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.C2H2N2O/c7-5-3-1-2-4-6-5;1-2-5-4-3-1/h1-4H2,(H,6,7);1-2H.
What are the key properties of oxadiazole;piperidin-2-one?
oxadiazole;piperidin-2-one has a molecular weight of 169.18 g/mol, XLogP of 0.36, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxadiazole;piperidin-2-one is sourced from PubChem (CID 157148463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).