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

C10H8N2O3 — CID 6096788

IUPAC5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one
SMILESO=c1[nH]c(-c2cccc(O)c2)ncc1O
InChIInChI=1S/C10H8N2O3/c13-7-3-1-2-6(4-7)9-11-5-8(14)10(15)12-9/h1-5,13-14H,(H,11,12,15)
InChIKeyWQYMFEMSXQZGQZ-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.85
Rot. Bonds1

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

5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one (PubChem CID 6096788) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one
PubChem CID6096788
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one
SMILESO=c1[nH]c(-c2cccc(O)c2)ncc1O
InChIInChI=1S/C10H8N2O3/c13-7-3-1-2-6(4-7)9-11-5-8(14)10(15)12-9/h1-5,13-14H,(H,11,12,15)
InChIKeyWQYMFEMSXQZGQZ-UHFFFAOYSA-N
XLogP0.85
TPSA86.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one?
The IUPAC name of 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one (CID 6096788) is 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one?
The canonical SMILES for 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one is O=c1[nH]c(-c2cccc(O)c2)ncc1O.
What is the InChIKey of 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one?
The InChIKey is WQYMFEMSXQZGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c13-7-3-1-2-6(4-7)9-11-5-8(14)10(15)12-9/h1-5,13-14H,(H,11,12,15).
What are the key properties of 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one?
5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one has a molecular weight of 204.19 g/mol, XLogP of 0.85, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2-(3-hydroxyphenyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 6096788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).