3-phenyl-2,5-dihydro-1H-pyridin-6-one

C11H11NO — CID 142702456

IUPAC3-phenyl-2,5-dihydro-1H-pyridin-6-one
SMILESO=C1CC=C(c2ccccc2)CN1
InChIInChI=1S/C11H11NO/c13-11-7-6-10(8-12-11)9-4-2-1-3-5-9/h1-6H,7-8H2,(H,12,13)
InChIKeyADOHOEQRYJTYFP-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.59
Rot. Bonds1

About 3-phenyl-2,5-dihydro-1H-pyridin-6-one

3-phenyl-2,5-dihydro-1H-pyridin-6-one (PubChem CID 142702456) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is 3-phenyl-2,5-dihydro-1H-pyridin-6-one.

Molecular Properties

Compound Name3-phenyl-2,5-dihydro-1H-pyridin-6-one
PubChem CID142702456
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Name3-phenyl-2,5-dihydro-1H-pyridin-6-one
SMILESO=C1CC=C(c2ccccc2)CN1
InChIInChI=1S/C11H11NO/c13-11-7-6-10(8-12-11)9-4-2-1-3-5-9/h1-6H,7-8H2,(H,12,13)
InChIKeyADOHOEQRYJTYFP-UHFFFAOYSA-N
XLogP1.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2,5-dihydro-1H-pyridin-6-one?
The IUPAC name of 3-phenyl-2,5-dihydro-1H-pyridin-6-one (CID 142702456) is 3-phenyl-2,5-dihydro-1H-pyridin-6-one.
What is the SMILES notation for 3-phenyl-2,5-dihydro-1H-pyridin-6-one?
The canonical SMILES for 3-phenyl-2,5-dihydro-1H-pyridin-6-one is O=C1CC=C(c2ccccc2)CN1.
What is the InChIKey of 3-phenyl-2,5-dihydro-1H-pyridin-6-one?
The InChIKey is ADOHOEQRYJTYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c13-11-7-6-10(8-12-11)9-4-2-1-3-5-9/h1-6H,7-8H2,(H,12,13).
What are the key properties of 3-phenyl-2,5-dihydro-1H-pyridin-6-one?
3-phenyl-2,5-dihydro-1H-pyridin-6-one has a molecular weight of 173.22 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2,5-dihydro-1H-pyridin-6-one is sourced from PubChem (CID 142702456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).