2-phenyl-2,3-dihydro-1H-pyridin-4-one

C11H11NO — CID 11745107

IUPAC2-phenyl-2,3-dihydro-1H-pyridin-4-one
SMILESO=C1C=CNC(c2ccccc2)C1
InChIInChI=1S/C11H11NO/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9/h1-7,11-12H,8H2
InChIKeyUHNSISVZKUXMPN-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.80
Rot. Bonds1

About 2-phenyl-2,3-dihydro-1H-pyridin-4-one

2-phenyl-2,3-dihydro-1H-pyridin-4-one (PubChem CID 11745107) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is 2-phenyl-2,3-dihydro-1H-pyridin-4-one.

Molecular Properties

Compound Name2-phenyl-2,3-dihydro-1H-pyridin-4-one
PubChem CID11745107
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Name2-phenyl-2,3-dihydro-1H-pyridin-4-one
SMILESO=C1C=CNC(c2ccccc2)C1
InChIInChI=1S/C11H11NO/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9/h1-7,11-12H,8H2
InChIKeyUHNSISVZKUXMPN-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2,3-dihydro-1H-pyridin-4-one?
The IUPAC name of 2-phenyl-2,3-dihydro-1H-pyridin-4-one (CID 11745107) is 2-phenyl-2,3-dihydro-1H-pyridin-4-one.
What is the SMILES notation for 2-phenyl-2,3-dihydro-1H-pyridin-4-one?
The canonical SMILES for 2-phenyl-2,3-dihydro-1H-pyridin-4-one is O=C1C=CNC(c2ccccc2)C1.
What is the InChIKey of 2-phenyl-2,3-dihydro-1H-pyridin-4-one?
The InChIKey is UHNSISVZKUXMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9/h1-7,11-12H,8H2.
What are the key properties of 2-phenyl-2,3-dihydro-1H-pyridin-4-one?
2-phenyl-2,3-dihydro-1H-pyridin-4-one has a molecular weight of 173.22 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2,3-dihydro-1H-pyridin-4-one is sourced from PubChem (CID 11745107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).