5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one

C11H12N2O2 — CID 70584276

IUPAC5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one
SMILESCc1cc(=O)[nH]c(O)c1C1=CCNC=C1
InChIInChI=1S/C11H12N2O2/c1-7-6-9(14)13-11(15)10(7)8-2-4-12-5-3-8/h2-4,6,12H,5H2,1H3,(H2,13,14,15)
InChIKeyJJOPNYOOVNXBGI-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.89
Rot. Bonds1

About 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one

5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one (PubChem CID 70584276) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one
PubChem CID70584276
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one
SMILESCc1cc(=O)[nH]c(O)c1C1=CCNC=C1
InChIInChI=1S/C11H12N2O2/c1-7-6-9(14)13-11(15)10(7)8-2-4-12-5-3-8/h2-4,6,12H,5H2,1H3,(H2,13,14,15)
InChIKeyJJOPNYOOVNXBGI-UHFFFAOYSA-N
XLogP0.89
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one?
The IUPAC name of 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one (CID 70584276) is 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one.
What is the SMILES notation for 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one?
The canonical SMILES for 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one is Cc1cc(=O)[nH]c(O)c1C1=CCNC=C1.
What is the InChIKey of 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one?
The InChIKey is JJOPNYOOVNXBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-7-6-9(14)13-11(15)10(7)8-2-4-12-5-3-8/h2-4,6,12H,5H2,1H3,(H2,13,14,15).
What are the key properties of 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one?
5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one has a molecular weight of 204.23 g/mol, XLogP of 0.89, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2-dihydropyridin-4-yl)-6-hydroxy-4-methyl-1H-pyridin-2-one is sourced from PubChem (CID 70584276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).