2-phenylpyrimidin-5-ol

C10H8N2O — CID 598996

IUPAC2-phenylpyrimidin-5-ol
SMILESOc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C10H8N2O/c13-9-6-11-10(12-7-9)8-4-2-1-3-5-8/h1-7,13H
InChIKeyVXOJYMHSOARYSV-UHFFFAOYSA-N
MW172.19 g/mol
LogP1.85
Rot. Bonds1

About 2-phenylpyrimidin-5-ol

2-phenylpyrimidin-5-ol (PubChem CID 598996) has the molecular formula C10H8N2O and a molecular weight of 172.19 g/mol. Its IUPAC name is 2-phenylpyrimidin-5-ol.

Molecular Properties

Compound Name2-phenylpyrimidin-5-ol
PubChem CID598996
Molecular FormulaC10H8N2O
Molecular Weight172.19 g/mol
Exact Mass172.06
IUPAC Name2-phenylpyrimidin-5-ol
SMILESOc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C10H8N2O/c13-9-6-11-10(12-7-9)8-4-2-1-3-5-8/h1-7,13H
InChIKeyVXOJYMHSOARYSV-UHFFFAOYSA-N
XLogP1.85
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.19
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenylpyrimidin-5-ol?
The IUPAC name of 2-phenylpyrimidin-5-ol (CID 598996) is 2-phenylpyrimidin-5-ol.
What is the SMILES notation for 2-phenylpyrimidin-5-ol?
The canonical SMILES for 2-phenylpyrimidin-5-ol is Oc1cnc(-c2ccccc2)nc1.
What is the InChIKey of 2-phenylpyrimidin-5-ol?
The InChIKey is VXOJYMHSOARYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O/c13-9-6-11-10(12-7-9)8-4-2-1-3-5-8/h1-7,13H.
What are the key properties of 2-phenylpyrimidin-5-ol?
2-phenylpyrimidin-5-ol has a molecular weight of 172.19 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpyrimidin-5-ol is sourced from PubChem (CID 598996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).