4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one

C10H12N2O2 — CID 66612298

IUPAC4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one
SMILESO=C1CCN(c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C10H12N2O2/c13-9-2-5-12(6-3-9)8-1-4-11-10(14)7-8/h1,4,7H,2-3,5-6H2,(H,11,14)
InChIKeyGXCQDSZAFVYEED-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.54
Rot. Bonds1

About 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one

4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one (PubChem CID 66612298) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one
PubChem CID66612298
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one
SMILESO=C1CCN(c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C10H12N2O2/c13-9-2-5-12(6-3-9)8-1-4-11-10(14)7-8/h1,4,7H,2-3,5-6H2,(H,11,14)
InChIKeyGXCQDSZAFVYEED-UHFFFAOYSA-N
XLogP0.54
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one?
The IUPAC name of 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one (CID 66612298) is 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one.
What is the SMILES notation for 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one?
The canonical SMILES for 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one is O=C1CCN(c2cc[nH]c(=O)c2)CC1.
What is the InChIKey of 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one?
The InChIKey is GXCQDSZAFVYEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-9-2-5-12(6-3-9)8-1-4-11-10(14)7-8/h1,4,7H,2-3,5-6H2,(H,11,14).
What are the key properties of 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one?
4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one has a molecular weight of 192.22 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-oxopiperidin-1-yl)-1H-pyridin-2-one is sourced from PubChem (CID 66612298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).