2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one

C7H12N4O — CID 84653055

IUPAC2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one
SMILESCN(C)c1cc(=O)n(C)c(N)n1
InChIInChI=1S/C7H12N4O/c1-10(2)5-4-6(12)11(3)7(8)9-5/h4H,1-3H3,(H2,8,9)
InChIKeyZBCYGYODKFPYMD-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.57
Rot. Bonds1

About 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one

2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one (PubChem CID 84653055) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one.

Molecular Properties

Compound Name2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one
PubChem CID84653055
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC Name2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one
SMILESCN(C)c1cc(=O)n(C)c(N)n1
InChIInChI=1S/C7H12N4O/c1-10(2)5-4-6(12)11(3)7(8)9-5/h4H,1-3H3,(H2,8,9)
InChIKeyZBCYGYODKFPYMD-UHFFFAOYSA-N
XLogP-0.57
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Amino-6-(dimethylamino)pyrimidin-4-ol
CID 135442218
6-Amino-3-methyl-3,4-dihydropyrimidin-4-one
CID 580359
6-Amino-2-(methylamino)pyrimidin-4-ol
CID 135455590
4(1H)-Pyrimidinone, 2,6-diamino-1-methyl-
CID 358313
2-Amino-6-(methylamino)pyrimidin-4-ol
CID 135577492
2-Amino-3-methyl-3,4-dihydropyrimidin-4-one
CID 10313133
4-Amino-2-dimethylamino-6-hydroxypyrimidine
CID 135431314
2-Amino-6-chloro-3-methyl-3,4-dihydropyrimidin-4-one
CID 69523869
3-Methyl-6-(methylamino)-4(3H)-pyrimidinone
CID 55288147
6-(Dimethylamino)-4(3H)-pyrimidinone
CID 135755308
2-amino-3,6-dimethylpyrimidin-4(3H)-one
CID 586932
1-Carbamimidoyl-3-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)guanidine
CID 176468647

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one?
The IUPAC name of 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one (CID 84653055) is 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one.
What is the SMILES notation for 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one?
The canonical SMILES for 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one is CN(C)c1cc(=O)n(C)c(N)n1.
What is the InChIKey of 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one?
The InChIKey is ZBCYGYODKFPYMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c1-10(2)5-4-6(12)11(3)7(8)9-5/h4H,1-3H3,(H2,8,9).
What are the key properties of 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one?
2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one has a molecular weight of 168.20 g/mol, XLogP of -0.57, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(dimethylamino)-3-methylpyrimidin-4-one is sourced from PubChem (CID 84653055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).