5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one

C7H10N2O2 — CID 135422502

IUPAC5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
SMILESCc1nc[nH]c(=O)c1CCO
InChIInChI=1S/C7H10N2O2/c1-5-6(2-3-10)7(11)9-4-8-5/h4,10H,2-3H2,1H3,(H,8,9,11)
InChIKeyOFMQXFQJWNNCQG-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.39
Rot. Bonds2

About 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one

5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one (PubChem CID 135422502) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
PubChem CID135422502
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
SMILESCc1nc[nH]c(=O)c1CCO
InChIInChI=1S/C7H10N2O2/c1-5-6(2-3-10)7(11)9-4-8-5/h4,10H,2-3H2,1H3,(H,8,9,11)
InChIKeyOFMQXFQJWNNCQG-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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Related Compounds

2-(4-methyl-6-oxo-1H-pyrimidin-5-yl)acetic acid
CID 135767357
ethyl 2-(4-methyl-6-oxo-1H-pyrimidin-5-yl)acetate
CID 135416561
N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide
CID 167992530
2-(dimethylamino)-5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
CID 135736976
2-(5-chloro-1,3-thiazol-2-yl)-5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
CID 136917806
5-ethenyl-4-methyl-1H-pyrimidin-6-one
CID 142197418
4-propan-2-yl-5-propyl-1H-pyrimidin-6-one
CID 136692838
4-methyl-5-[(Z)-prop-1-enyl]-1H-pyrimidin-6-one;propane
CID 142610528
2-(4-fluoroanilino)-5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
CID 135612041
5-(2-hydroxyethyl)-4-methyl-2-(2-methylpyrazol-3-yl)-1H-pyrimidin-6-one
CID 137005311
2-(2-aminoethylamino)-5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
CID 136925171
2-(4-anilinoanilino)-5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one
CID 135612093

Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one?
The IUPAC name of 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one (CID 135422502) is 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one is Cc1nc[nH]c(=O)c1CCO.
What is the InChIKey of 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one?
The InChIKey is OFMQXFQJWNNCQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-6(2-3-10)7(11)9-4-8-5/h4,10H,2-3H2,1H3,(H,8,9,11).
What are the key properties of 5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-one?
5-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-6-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)-4-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 135422502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).