6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one

C12H11NO2 — CID 53217580

IUPAC6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one
SMILESO=c1cccc(-c2ccc(CO)cc2)[nH]1
InChIInChI=1S/C12H11NO2/c14-8-9-4-6-10(7-5-9)11-2-1-3-12(15)13-11/h1-7,14H,8H2,(H,13,15)
InChIKeyUUFWHVPRPBHFKS-UHFFFAOYSA-N
MW201.22 g/mol
LogP1.53
Rot. Bonds2

About 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one

6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one (PubChem CID 53217580) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one
PubChem CID53217580
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one
SMILESO=c1cccc(-c2ccc(CO)cc2)[nH]1
InChIInChI=1S/C12H11NO2/c14-8-9-4-6-10(7-5-9)11-2-1-3-12(15)13-11/h1-7,14H,8H2,(H,13,15)
InChIKeyUUFWHVPRPBHFKS-UHFFFAOYSA-N
XLogP1.53
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one?
The IUPAC name of 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one (CID 53217580) is 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one?
The canonical SMILES for 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one is O=c1cccc(-c2ccc(CO)cc2)[nH]1.
What is the InChIKey of 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one?
The InChIKey is UUFWHVPRPBHFKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-8-9-4-6-10(7-5-9)11-2-1-3-12(15)13-11/h1-7,14H,8H2,(H,13,15).
What are the key properties of 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one?
6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one has a molecular weight of 201.22 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(hydroxymethyl)phenyl]-1H-pyridin-2-one is sourced from PubChem (CID 53217580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).