5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one

C11H10N2O2 — CID 13377503

IUPAC5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one
SMILESCc1[nH]c(=O)ncc1-c1cccc(O)c1
InChIInChI=1S/C11H10N2O2/c1-7-10(6-12-11(15)13-7)8-3-2-4-9(14)5-8/h2-6,14H,1H3,(H,12,13,15)
InChIKeyHDBUXQVATBYXFX-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.45
Rot. Bonds1

About 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one

5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one (PubChem CID 13377503) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one.

Molecular Properties

Compound Name5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one
PubChem CID13377503
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one
SMILESCc1[nH]c(=O)ncc1-c1cccc(O)c1
InChIInChI=1S/C11H10N2O2/c1-7-10(6-12-11(15)13-7)8-3-2-4-9(14)5-8/h2-6,14H,1H3,(H,12,13,15)
InChIKeyHDBUXQVATBYXFX-UHFFFAOYSA-N
XLogP1.45
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one?
The IUPAC name of 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one (CID 13377503) is 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one.
What is the SMILES notation for 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one?
The canonical SMILES for 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one is Cc1[nH]c(=O)ncc1-c1cccc(O)c1.
What is the InChIKey of 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one?
The InChIKey is HDBUXQVATBYXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-10(6-12-11(15)13-7)8-3-2-4-9(14)5-8/h2-6,14H,1H3,(H,12,13,15).
What are the key properties of 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one?
5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one has a molecular weight of 202.21 g/mol, XLogP of 1.45, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxyphenyl)-6-methyl-1H-pyrimidin-2-one is sourced from PubChem (CID 13377503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).