5-phenylmethoxy-4H-pyridin-3-one

C12H11NO2 — CID 151393318

IUPAC5-phenylmethoxy-4H-pyridin-3-one
SMILESO=C1C=NC=C(OCc2ccccc2)C1
InChIInChI=1S/C12H11NO2/c14-11-6-12(8-13-7-11)15-9-10-4-2-1-3-5-10/h1-5,7-8H,6,9H2
InChIKeyOUXKXSYGGXJEIN-UHFFFAOYSA-N
MW201.23 g/mol
LogP2.09
Rot. Bonds3

About 5-phenylmethoxy-4H-pyridin-3-one

5-phenylmethoxy-4H-pyridin-3-one (PubChem CID 151393318) has the molecular formula C12H11NO2 and a molecular weight of 201.23 g/mol. Its IUPAC name is 5-phenylmethoxy-4H-pyridin-3-one.

Molecular Properties

Compound Name5-phenylmethoxy-4H-pyridin-3-one
PubChem CID151393318
Molecular FormulaC12H11NO2
Molecular Weight201.23 g/mol
Exact Mass201.08
IUPAC Name5-phenylmethoxy-4H-pyridin-3-one
SMILESO=C1C=NC=C(OCc2ccccc2)C1
InChIInChI=1S/C12H11NO2/c14-11-6-12(8-13-7-11)15-9-10-4-2-1-3-5-10/h1-5,7-8H,6,9H2
InChIKeyOUXKXSYGGXJEIN-UHFFFAOYSA-N
XLogP2.09
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-phenylmethoxy-4H-pyridin-3-one?
The IUPAC name of 5-phenylmethoxy-4H-pyridin-3-one (CID 151393318) is 5-phenylmethoxy-4H-pyridin-3-one.
What is the SMILES notation for 5-phenylmethoxy-4H-pyridin-3-one?
The canonical SMILES for 5-phenylmethoxy-4H-pyridin-3-one is O=C1C=NC=C(OCc2ccccc2)C1.
What is the InChIKey of 5-phenylmethoxy-4H-pyridin-3-one?
The InChIKey is OUXKXSYGGXJEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-11-6-12(8-13-7-11)15-9-10-4-2-1-3-5-10/h1-5,7-8H,6,9H2.
What are the key properties of 5-phenylmethoxy-4H-pyridin-3-one?
5-phenylmethoxy-4H-pyridin-3-one has a molecular weight of 201.23 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylmethoxy-4H-pyridin-3-one is sourced from PubChem (CID 151393318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).