5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one

C9H15N3O — CID 18334367

IUPAC5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one
SMILESCCc1c(NC)nc(C)n(C)c1=O
InChIInChI=1S/C9H15N3O/c1-5-7-8(10-3)11-6(2)12(4)9(7)13/h10H,5H2,1-4H3
InChIKeyGNDWHYDRGXFNJO-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.69
Rot. Bonds2

About 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one

5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one (PubChem CID 18334367) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one.

Molecular Properties

Compound Name5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one
PubChem CID18334367
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one
SMILESCCc1c(NC)nc(C)n(C)c1=O
InChIInChI=1S/C9H15N3O/c1-5-7-8(10-3)11-6(2)12(4)9(7)13/h10H,5H2,1-4H3
InChIKeyGNDWHYDRGXFNJO-UHFFFAOYSA-N
XLogP0.69
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Pyrimidinol, 6-amino-5-ethyl-2-methyl-
CID 135854958
2-Ethyl-3,5-dimethyl-6-(methylamino)pyrimidin-4-one
CID 18334338
3-Ethyl-2,5-dimethyl-6-(methylamino)pyrimidin-4-one
CID 18334352
6-(Ethylamino)-2,3,5-trimethylpyrimidin-4-one
CID 18334378
2,5-dimethyl-4-(methylamino)-1H-pyrimidin-6-one
CID 135682069
4-(ethylamino)-2,5-dimethyl-1H-pyrimidin-6-one
CID 136081902
6-(Ethylamino)-2-methyl-5-(1-methylethyl)-4-pyrimidinol
CID 136087602
6-Amino-2,5-ditert-butyl-3-methylpyrimidin-4-one
CID 162501135
4-(dimethylamino)-2,5-dimethyl-1H-pyrimidin-6-one
CID 170231364
5-(2-Aminoethyl)-2,3-dimethylpyrimidin-4-one
CID 83873637
2,3-Dimethyl-5-[2-(methylamino)ethyl]pyrimidin-4-one
CID 83875792
5-(2-Aminoethyl)-3-ethyl-2-methylpyrimidin-4-one
CID 83875796

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one?
The IUPAC name of 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one (CID 18334367) is 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one.
What is the SMILES notation for 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one?
The canonical SMILES for 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one is CCc1c(NC)nc(C)n(C)c1=O.
What is the InChIKey of 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one?
The InChIKey is GNDWHYDRGXFNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-5-7-8(10-3)11-6(2)12(4)9(7)13/h10H,5H2,1-4H3.
What are the key properties of 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one?
5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one has a molecular weight of 181.24 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,3-dimethyl-6-(methylamino)pyrimidin-4-one is sourced from PubChem (CID 18334367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).