5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one

C11H10N2O3 — CID 71185914

IUPAC5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one
SMILESO=c1[nH]c(COc2ccccc2)ncc1O
InChIInChI=1S/C11H10N2O3/c14-9-6-12-10(13-11(9)15)7-16-8-4-2-1-3-5-8/h1-6,14H,7H2,(H,12,13,15)
InChIKeyLWUONLVDVDARNX-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.05
Rot. Bonds3

About 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one

5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one (PubChem CID 71185914) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one
PubChem CID71185914
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one
SMILESO=c1[nH]c(COc2ccccc2)ncc1O
InChIInChI=1S/C11H10N2O3/c14-9-6-12-10(13-11(9)15)7-16-8-4-2-1-3-5-8/h1-6,14H,7H2,(H,12,13,15)
InChIKeyLWUONLVDVDARNX-UHFFFAOYSA-N
XLogP1.05
TPSA75.21 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-Pyrimidinol, 6-methyl-2-(phenoxymethyl)-
CID 135403423
2-Amino-5-phenoxy-4-pyrimidinol
CID 4193906
4-Hydroxy-5-phenoxy pyrimidine
CID 12661854
4-Pyrimidinol, 6-methyl-2-((2-methoxyphenoxy)methyl)-
CID 135746696
5-(4-methoxyphenoxy)-1H-pyrimidin-6-one
CID 12661863
5-(Morpholin-4-ylcarbonyl)-2-(phenoxymethyl)pyrimidin-4-ol
CID 72853280
4-hydroxy-2-[(2-methoxyphenoxy)methyl]-1H-pyrimidin-6-one
CID 172438534
4-methyl-2-[2-[[(2S)-1-phenoxypropan-2-yl]amino]ethyl]-1H-pyrimidin-6-one
CID 136743328
2-amino-5-(4-fluorophenoxy)-1H-pyrimidin-6-one
CID 18432502
2-amino-5-(3-fluorophenoxy)-1H-pyrimidin-6-one
CID 18432510
5-(4-fluoro-2-methoxyphenoxy)-4-hydroxy-2-methyl-1H-pyrimidin-6-one
CID 53815933
5-(2,4-difluorophenoxy)-2-(methylsulfanylmethyl)-1H-pyrimidin-6-one
CID 134311331

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one?
The IUPAC name of 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one (CID 71185914) is 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one?
The canonical SMILES for 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one is O=c1[nH]c(COc2ccccc2)ncc1O.
What is the InChIKey of 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one?
The InChIKey is LWUONLVDVDARNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c14-9-6-12-10(13-11(9)15)7-16-8-4-2-1-3-5-8/h1-6,14H,7H2,(H,12,13,15).
What are the key properties of 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one?
5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one has a molecular weight of 218.21 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2-(phenoxymethyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 71185914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).