5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one

C7H10N2O2 — CID 115070138

IUPAC5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one
SMILESCc1[nH]c(=O)ncc1CCO
InChIInChI=1S/C7H10N2O2/c1-5-6(2-3-10)4-8-7(11)9-5/h4,10H,2-3H2,1H3,(H,8,9,11)
InChIKeyAOCAXVPJOZUZLY-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.39
Rot. Bonds2

About 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one

5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one (PubChem CID 115070138) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one.

Molecular Properties

Compound Name5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one
PubChem CID115070138
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one
SMILESCc1[nH]c(=O)ncc1CCO
InChIInChI=1S/C7H10N2O2/c1-5-6(2-3-10)4-8-7(11)9-5/h4,10H,2-3H2,1H3,(H,8,9,11)
InChIKeyAOCAXVPJOZUZLY-UHFFFAOYSA-N
XLogP-0.39
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one?
The IUPAC name of 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one (CID 115070138) is 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one.
What is the SMILES notation for 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one?
The canonical SMILES for 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one is Cc1[nH]c(=O)ncc1CCO.
What is the InChIKey of 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one?
The InChIKey is AOCAXVPJOZUZLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-6(2-3-10)4-8-7(11)9-5/h4,10H,2-3H2,1H3,(H,8,9,11).
What are the key properties of 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one?
5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one has a molecular weight of 154.17 g/mol, XLogP of -0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxyethyl)-6-methyl-1H-pyrimidin-2-one is sourced from PubChem (CID 115070138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).