5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one

C11H11N3O — CID 106520467

IUPAC5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one
SMILESCc1cncc(-c2[nH]c(=O)ncc2C)c1
InChIInChI=1S/C11H11N3O/c1-7-3-9(6-12-4-7)10-8(2)5-13-11(15)14-10/h3-6H,1-2H3,(H,13,14,15)
InChIKeyMKQREACEZGHKBS-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.45
Rot. Bonds1

About 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one

5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one (PubChem CID 106520467) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one.

Molecular Properties

Compound Name5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one
PubChem CID106520467
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one
SMILESCc1cncc(-c2[nH]c(=O)ncc2C)c1
InChIInChI=1S/C11H11N3O/c1-7-3-9(6-12-4-7)10-8(2)5-13-11(15)14-10/h3-6H,1-2H3,(H,13,14,15)
InChIKeyMKQREACEZGHKBS-UHFFFAOYSA-N
XLogP1.45
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-1H-pyrimidin-2-one
CID 106884727
6-(1-ethylpyrazol-4-yl)-5-methyl-1H-pyrimidin-2-one
CID 106515932
6-(4-fluoro-2-methylphenyl)-5-methyl-1H-pyrimidin-2-one
CID 106514972
5-fluoro-6-(5-methyl-3-pyridinyl)-1H-pyrimidine-2-thione
CID 106520460
methyl 3-fluoro-5-(5-methyl-2-oxo-1H-pyrimidin-6-yl)benzoate
CID 106522923
5-(5-methyl-3-pyridinyl)-1H-pyrazol-4-amine
CID 165495741
3-(5-methyl-3-pyridinyl)-1H-pyridazin-6-one
CID 20522388
7-methyl-1H-pyrido[3,2-d]pyrimidin-2-one
CID 170056017
6-(3-methylphenyl)-2-oxo-1H-pyrimidine-5-carboxylic acid
CID 83711439
6-(2,4-dimethylphenyl)-5-fluoro-1H-pyrimidin-2-one
CID 106516880
ethane;5-(5-methyl-3-pyridinyl)-1,2-oxazol-3-one
CID 145106828
6,8-dimethyl-1H-quinazolin-2-one
CID 163903053

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one?
The IUPAC name of 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one (CID 106520467) is 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one.
What is the SMILES notation for 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one?
The canonical SMILES for 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one is Cc1cncc(-c2[nH]c(=O)ncc2C)c1.
What is the InChIKey of 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one?
The InChIKey is MKQREACEZGHKBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-7-3-9(6-12-4-7)10-8(2)5-13-11(15)14-10/h3-6H,1-2H3,(H,13,14,15).
What are the key properties of 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one?
5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one has a molecular weight of 201.23 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-(5-methyl-3-pyridinyl)-1H-pyrimidin-2-one is sourced from PubChem (CID 106520467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).