3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one

C10H12N2O2 — CID 54397635

IUPAC3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one
SMILESO=C1NCCCC1c1ccc[nH]c1=O
InChIInChI=1S/C10H12N2O2/c13-9-7(3-1-5-11-9)8-4-2-6-12-10(8)14/h1,3,5,8H,2,4,6H2,(H,11,13)(H,12,14)
InChIKeyPDAPBRZISQLKQE-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.37
Rot. Bonds1

About 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one

3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one (PubChem CID 54397635) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one
PubChem CID54397635
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one
SMILESO=C1NCCCC1c1ccc[nH]c1=O
InChIInChI=1S/C10H12N2O2/c13-9-7(3-1-5-11-9)8-4-2-6-12-10(8)14/h1,3,5,8H,2,4,6H2,(H,11,13)(H,12,14)
InChIKeyPDAPBRZISQLKQE-UHFFFAOYSA-N
XLogP0.37
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one?
The IUPAC name of 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one (CID 54397635) is 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one?
The canonical SMILES for 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one is O=C1NCCCC1c1ccc[nH]c1=O.
What is the InChIKey of 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one?
The InChIKey is PDAPBRZISQLKQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-9-7(3-1-5-11-9)8-4-2-6-12-10(8)14/h1,3,5,8H,2,4,6H2,(H,11,13)(H,12,14).
What are the key properties of 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one?
3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one has a molecular weight of 192.22 g/mol, XLogP of 0.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxopiperidin-3-yl)-1H-pyridin-2-one is sourced from PubChem (CID 54397635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).