6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one

C12H13N3O — CID 19754156

IUPAC6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one
SMILESCNc1nc(=O)cc(C)n1-c1ccccc1
InChIInChI=1S/C12H13N3O/c1-9-8-11(16)14-12(13-2)15(9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,14,16)
InChIKeyHUJBNCDIVCYPTH-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.58
Rot. Bonds2

About 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one

6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one (PubChem CID 19754156) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one.

Molecular Properties

Compound Name6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one
PubChem CID19754156
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one
SMILESCNc1nc(=O)cc(C)n1-c1ccccc1
InChIInChI=1S/C12H13N3O/c1-9-8-11(16)14-12(13-2)15(9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,14,16)
InChIKeyHUJBNCDIVCYPTH-UHFFFAOYSA-N
XLogP1.58
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-2-(4-methylanilino)-1-phenylpyrimidin-4-one
CID 10171691
2,6-dimethyl-3-phenylpyrimidin-4-one
CID 608225
2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-methyl-3-phenylpyrimidin-4-one
CID 23762620
2-amino-1-(4-methoxyphenyl)-6-methylpyrimidin-4-one
CID 19754215
1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-methylmethanamine
CID 43090175
2-benzyl-6-methyl-3-phenylpyrimidin-4-one
CID 13280786
methyl 2,5-dimethyl-1-phenylpyrrole-3-carboxylate
CID 14611450
2,5-dichloro-6-methyl-3-phenylpyrimidin-4-one
CID 154123785
6-(chloromethyl)-2-methylsulfanyl-1-phenylpyrimidin-4-one
CID 14222690
6-chloro-2-methyl-1-phenylindole
CID 171405843
2,3,6-triphenylpyrimidin-4-one
CID 13280772
2-(methylamino)-3-phenyl-6-propylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one
CID 155901085

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one?
The IUPAC name of 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one (CID 19754156) is 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one.
What is the SMILES notation for 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one?
The canonical SMILES for 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one is CNc1nc(=O)cc(C)n1-c1ccccc1.
What is the InChIKey of 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one?
The InChIKey is HUJBNCDIVCYPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-9-8-11(16)14-12(13-2)15(9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,14,16).
What are the key properties of 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one?
6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one has a molecular weight of 215.26 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(methylamino)-1-phenylpyrimidin-4-one is sourced from PubChem (CID 19754156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).