5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one

C8H13N3O2 — CID 137258015

IUPAC5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one
SMILESCNCc1nc(C)c(OC)c(=O)[nH]1
InChIInChI=1S/C8H13N3O2/c1-5-7(13-3)8(12)11-6(10-5)4-9-2/h9H,4H2,1-3H3,(H,10,11,12)
InChIKeyHXBGDHFZQPKNDI-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.19
Rot. Bonds3

About 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one

5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one (PubChem CID 137258015) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one
PubChem CID137258015
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one
SMILESCNCc1nc(C)c(OC)c(=O)[nH]1
InChIInChI=1S/C8H13N3O2/c1-5-7(13-3)8(12)11-6(10-5)4-9-2/h9H,4H2,1-3H3,(H,10,11,12)
InChIKeyHXBGDHFZQPKNDI-UHFFFAOYSA-N
XLogP-0.19
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-aminoethyl)-5-methoxy-4-methyl-1H-pyrimidin-6-one
CID 137259074
5-methoxy-4-methyl-2-(2-methyltetrazol-5-yl)-1H-pyrimidin-6-one
CID 137429401
7-fluoro-2-(methylaminomethyl)-3H-quinazolin-4-one
CID 136661154
5-methoxy-4-methyl-2-(4-methyl-1,3-thiazol-2-yl)-1H-pyrimidin-6-one
CID 137429404
2-(methylaminomethyl)-7-(trifluoromethyl)-3H-quinazolin-4-one
CID 136900817
1-(4,5-dimethyl-1H-imidazol-2-yl)-N-methoxymethanamine
CID 82595689
2-[(2-methoxyphenyl)methyl]-4,5-dimethyl-1H-pyrimidin-6-one
CID 135973576
3-(methylaminomethyl)-1,4-dihydro-1,2,4-triazol-5-one;hydrochloride
CID 135905243
1-[5-bromo-4-(2-methoxy-4,5-dimethylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 84606053
methyl 5-(methylaminomethyl)-1H-1,2,4-triazole-3-carboxylate
CID 105434404
1-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]-N-methylmethanamine;dihydrochloride
CID 72716184
2-(methylaminomethyl)-4-phenyl-1H-pyrimidin-6-one
CID 135577957

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one?
The IUPAC name of 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one (CID 137258015) is 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one?
The canonical SMILES for 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one is CNCc1nc(C)c(OC)c(=O)[nH]1.
What is the InChIKey of 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one?
The InChIKey is HXBGDHFZQPKNDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-5-7(13-3)8(12)11-6(10-5)4-9-2/h9H,4H2,1-3H3,(H,10,11,12).
What are the key properties of 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one?
5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one has a molecular weight of 183.21 g/mol, XLogP of -0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 137258015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).