2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one

C11H19N3O — CID 59881373

IUPAC2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one
SMILESCCCN(C)Cc1cnc(C)n(C)c1=O
InChIInChI=1S/C11H19N3O/c1-5-6-13(3)8-10-7-12-9(2)14(4)11(10)15/h7H,5-6,8H2,1-4H3
InChIKeyMEYZSFMYQUGKSA-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.93
Rot. Bonds4

About 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one

2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one (PubChem CID 59881373) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one.

Molecular Properties

Compound Name2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one
PubChem CID59881373
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one
SMILESCCCN(C)Cc1cnc(C)n(C)c1=O
InChIInChI=1S/C11H19N3O/c1-5-6-13(3)8-10-7-12-9(2)14(4)11(10)15/h7H,5-6,8H2,1-4H3
InChIKeyMEYZSFMYQUGKSA-UHFFFAOYSA-N
XLogP0.93
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-7,8-dihydropyrrolo[1,2-a]pyrimidin-4(6H)-one
CID 641889
3-Ethyl-2-methoxy-5-methylpyrimidin-4-one
CID 21627126
3-Tert-butyl-2,5-dimethylpyrimidin-4-one
CID 54212695
3-[2-(Dimethylamino)ethyl]-5-methylpyrimidin-4-one
CID 57583977
2,3,5-Trimethylpyrimidin-4-one
CID 59134427
2-[3-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methylamino]propyl]guanidine
CID 66581406
3-Ethyl-5-methylpyrimidin-4-one
CID 89410488
5-Methyl-3-(propan-2-yl)-3,4-dihydropyrimidin-4-one
CID 123408388
1,2-Dimethyl-6-oxopyrimidine-5-carboxamide
CID 129935352
5-Methyl-1,2-di(propan-2-yl)pyrimidin-4-one
CID 140905805
1,2-Dimethyl-6-oxopyrimidine-5-carboxamide;ethane
CID 141822291
1,2-Dimethyl-6-oxopyrimidine-5-carbaldehyde;ethane
CID 141822443

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one?
The IUPAC name of 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one (CID 59881373) is 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one.
What is the SMILES notation for 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one?
The canonical SMILES for 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one is CCCN(C)Cc1cnc(C)n(C)c1=O.
What is the InChIKey of 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one?
The InChIKey is MEYZSFMYQUGKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-6-13(3)8-10-7-12-9(2)14(4)11(10)15/h7H,5-6,8H2,1-4H3.
What are the key properties of 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one?
2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one has a molecular weight of 209.29 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-[[methyl(propyl)amino]methyl]pyrimidin-4-one is sourced from PubChem (CID 59881373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).