pyrimidin-5-ol

C4H4N2O — CID 565855

IUPACpyrimidin-5-ol
SMILESOc1cncnc1
InChIInChI=1S/C4H4N2O/c7-4-1-5-3-6-2-4/h1-3,7H
InChIKeyLTXJLQINBYSQFU-UHFFFAOYSA-N
MW96.09 g/mol
LogP0.18
Rot. Bonds

About pyrimidin-5-ol

pyrimidin-5-ol (PubChem CID 565855) has the molecular formula C4H4N2O and a molecular weight of 96.09 g/mol. Its IUPAC name is pyrimidin-5-ol.

Molecular Properties

Compound Namepyrimidin-5-ol
PubChem CID565855
Molecular FormulaC4H4N2O
Molecular Weight96.09 g/mol
Exact Mass96.03
IUPAC Namepyrimidin-5-ol
SMILESOc1cncnc1
InChIInChI=1S/C4H4N2O/c7-4-1-5-3-6-2-4/h1-3,7H
InChIKeyLTXJLQINBYSQFU-UHFFFAOYSA-N
XLogP0.18
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.09
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyrimidin-5-ol?
The IUPAC name of pyrimidin-5-ol (CID 565855) is pyrimidin-5-ol.
What is the SMILES notation for pyrimidin-5-ol?
The canonical SMILES for pyrimidin-5-ol is Oc1cncnc1.
What is the InChIKey of pyrimidin-5-ol?
The InChIKey is LTXJLQINBYSQFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2O/c7-4-1-5-3-6-2-4/h1-3,7H.
What are the key properties of pyrimidin-5-ol?
pyrimidin-5-ol has a molecular weight of 96.09 g/mol, XLogP of 0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrimidin-5-ol is sourced from PubChem (CID 565855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).