1-(2-hydroxyethyl)pyrimidine-2,4-dione

C6H8N2O3 — CID 11030057

IUPAC1-(2-hydroxyethyl)pyrimidine-2,4-dione
SMILESO=c1ccn(CCO)c(=O)[nH]1
InChIInChI=1S/C6H8N2O3/c9-4-3-8-2-1-5(10)7-6(8)11/h1-2,9H,3-4H2,(H,7,10,11)
InChIKeyWPOIKUYNYCMJLT-UHFFFAOYSA-N
MW156.14 g/mol
LogP-1.47
Rot. Bonds2

About 1-(2-hydroxyethyl)pyrimidine-2,4-dione

1-(2-hydroxyethyl)pyrimidine-2,4-dione (PubChem CID 11030057) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-(2-hydroxyethyl)pyrimidine-2,4-dione
PubChem CID11030057
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC Name1-(2-hydroxyethyl)pyrimidine-2,4-dione
SMILESO=c1ccn(CCO)c(=O)[nH]1
InChIInChI=1S/C6H8N2O3/c9-4-3-8-2-1-5(10)7-6(8)11/h1-2,9H,3-4H2,(H,7,10,11)
InChIKeyWPOIKUYNYCMJLT-UHFFFAOYSA-N
XLogP-1.47
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 5-1.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)pyrimidine-2,4-dione?
The IUPAC name of 1-(2-hydroxyethyl)pyrimidine-2,4-dione (CID 11030057) is 1-(2-hydroxyethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 1-(2-hydroxyethyl)pyrimidine-2,4-dione?
The canonical SMILES for 1-(2-hydroxyethyl)pyrimidine-2,4-dione is O=c1ccn(CCO)c(=O)[nH]1.
What is the InChIKey of 1-(2-hydroxyethyl)pyrimidine-2,4-dione?
The InChIKey is WPOIKUYNYCMJLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c9-4-3-8-2-1-5(10)7-6(8)11/h1-2,9H,3-4H2,(H,7,10,11).
What are the key properties of 1-(2-hydroxyethyl)pyrimidine-2,4-dione?
1-(2-hydroxyethyl)pyrimidine-2,4-dione has a molecular weight of 156.14 g/mol, XLogP of -1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 11030057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).