2,3-dihydroxy-1,2-dihydropyrimidin-6-one

C4H6N2O3 — CID 141173753

IUPAC2,3-dihydroxy-1,2-dihydropyrimidin-6-one
SMILESO=C1C=CN(O)C(O)N1
InChIInChI=1S/C4H6N2O3/c7-3-1-2-6(9)4(8)5-3/h1-2,4,8-9H,(H,5,7)
InChIKeyXEUGJEOXCRDBMA-UHFFFAOYSA-N
MW130.10 g/mol
LogP-1.40
Rot. Bonds

About 2,3-dihydroxy-1,2-dihydropyrimidin-6-one

2,3-dihydroxy-1,2-dihydropyrimidin-6-one (PubChem CID 141173753) has the molecular formula C4H6N2O3 and a molecular weight of 130.10 g/mol. Its IUPAC name is 2,3-dihydroxy-1,2-dihydropyrimidin-6-one.

Molecular Properties

Compound Name2,3-dihydroxy-1,2-dihydropyrimidin-6-one
PubChem CID141173753
Molecular FormulaC4H6N2O3
Molecular Weight130.10 g/mol
Exact Mass130.04
IUPAC Name2,3-dihydroxy-1,2-dihydropyrimidin-6-one
SMILESO=C1C=CN(O)C(O)N1
InChIInChI=1S/C4H6N2O3/c7-3-1-2-6(9)4(8)5-3/h1-2,4,8-9H,(H,5,7)
InChIKeyXEUGJEOXCRDBMA-UHFFFAOYSA-N
XLogP-1.40
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.10
LogP ≤ 5-1.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-1,2-dihydropyrimidin-6-one?
The IUPAC name of 2,3-dihydroxy-1,2-dihydropyrimidin-6-one (CID 141173753) is 2,3-dihydroxy-1,2-dihydropyrimidin-6-one.
What is the SMILES notation for 2,3-dihydroxy-1,2-dihydropyrimidin-6-one?
The canonical SMILES for 2,3-dihydroxy-1,2-dihydropyrimidin-6-one is O=C1C=CN(O)C(O)N1.
What is the InChIKey of 2,3-dihydroxy-1,2-dihydropyrimidin-6-one?
The InChIKey is XEUGJEOXCRDBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O3/c7-3-1-2-6(9)4(8)5-3/h1-2,4,8-9H,(H,5,7).
What are the key properties of 2,3-dihydroxy-1,2-dihydropyrimidin-6-one?
2,3-dihydroxy-1,2-dihydropyrimidin-6-one has a molecular weight of 130.10 g/mol, XLogP of -1.40, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-1,2-dihydropyrimidin-6-one is sourced from PubChem (CID 141173753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).