1,2-dihydropyrimidin-2-ol

C4H6N2O — CID 18356393

IUPAC1,2-dihydropyrimidin-2-ol
SMILESOC1N=CC=CN1
InChIInChI=1S/C4H6N2O/c7-4-5-2-1-3-6-4/h1-5,7H
InChIKeyYWZYBXFVTOHTEJ-UHFFFAOYSA-N
MW98.10 g/mol
LogP-0.55
Rot. Bonds

About 1,2-dihydropyrimidin-2-ol

1,2-dihydropyrimidin-2-ol (PubChem CID 18356393) has the molecular formula C4H6N2O and a molecular weight of 98.10 g/mol. Its IUPAC name is 1,2-dihydropyrimidin-2-ol.

Molecular Properties

Compound Name1,2-dihydropyrimidin-2-ol
PubChem CID18356393
Molecular FormulaC4H6N2O
Molecular Weight98.10 g/mol
Exact Mass98.05
IUPAC Name1,2-dihydropyrimidin-2-ol
SMILESOC1N=CC=CN1
InChIInChI=1S/C4H6N2O/c7-4-5-2-1-3-6-4/h1-5,7H
InChIKeyYWZYBXFVTOHTEJ-UHFFFAOYSA-N
XLogP-0.55
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.10
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dihydropyrimidin-2-ol?
The IUPAC name of 1,2-dihydropyrimidin-2-ol (CID 18356393) is 1,2-dihydropyrimidin-2-ol.
What is the SMILES notation for 1,2-dihydropyrimidin-2-ol?
The canonical SMILES for 1,2-dihydropyrimidin-2-ol is OC1N=CC=CN1.
What is the InChIKey of 1,2-dihydropyrimidin-2-ol?
The InChIKey is YWZYBXFVTOHTEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O/c7-4-5-2-1-3-6-4/h1-5,7H.
What are the key properties of 1,2-dihydropyrimidin-2-ol?
1,2-dihydropyrimidin-2-ol has a molecular weight of 98.10 g/mol, XLogP of -0.55, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydropyrimidin-2-ol is sourced from PubChem (CID 18356393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).