3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one

C6H10N2O2 — CID 118952499

IUPAC3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one
SMILESO=C1NCC=CN1CCO
InChIInChI=1S/C6H10N2O2/c9-5-4-8-3-1-2-7-6(8)10/h1,3,9H,2,4-5H2,(H,7,10)
InChIKeyAHMYRPJNPYBZMO-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.48
Rot. Bonds2

About 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one

3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one (PubChem CID 118952499) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one
PubChem CID118952499
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one
SMILESO=C1NCC=CN1CCO
InChIInChI=1S/C6H10N2O2/c9-5-4-8-3-1-2-7-6(8)10/h1,3,9H,2,4-5H2,(H,7,10)
InChIKeyAHMYRPJNPYBZMO-UHFFFAOYSA-N
XLogP-0.48
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one?
The IUPAC name of 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one (CID 118952499) is 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one.
What is the SMILES notation for 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one?
The canonical SMILES for 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one is O=C1NCC=CN1CCO.
What is the InChIKey of 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one?
The InChIKey is AHMYRPJNPYBZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c9-5-4-8-3-1-2-7-6(8)10/h1,3,9H,2,4-5H2,(H,7,10).
What are the key properties of 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one?
3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one has a molecular weight of 142.16 g/mol, XLogP of -0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethyl)-1,6-dihydropyrimidin-2-one is sourced from PubChem (CID 118952499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).