2-(ethenylamino)-3-methylpyrimidin-4-one

C7H9N3O — CID 89073017

IUPAC2-(ethenylamino)-3-methylpyrimidin-4-one
SMILESC=CNc1nccc(=O)n1C
InChIInChI=1S/C7H9N3O/c1-3-8-7-9-5-4-6(11)10(7)2/h3-5H,1H2,2H3,(H,8,9)
InChIKeyDISJMNIKJQZCCJ-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.34
Rot. Bonds2

About 2-(ethenylamino)-3-methylpyrimidin-4-one

2-(ethenylamino)-3-methylpyrimidin-4-one (PubChem CID 89073017) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 2-(ethenylamino)-3-methylpyrimidin-4-one.

Molecular Properties

Compound Name2-(ethenylamino)-3-methylpyrimidin-4-one
PubChem CID89073017
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name2-(ethenylamino)-3-methylpyrimidin-4-one
SMILESC=CNc1nccc(=O)n1C
InChIInChI=1S/C7H9N3O/c1-3-8-7-9-5-4-6(11)10(7)2/h3-5H,1H2,2H3,(H,8,9)
InChIKeyDISJMNIKJQZCCJ-UHFFFAOYSA-N
XLogP0.34
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Isocytosine
CID 66950
2-(Dimethylamino)pyrimidin-4-ol
CID 817200
6-Amino-2-(methylamino)pyrimidin-4-ol
CID 135455590
5H,8H-imidazo[1,2-a]pyrimidin-5-one
CID 12258611
2-Amino-3-methyl-3,4-dihydropyrimidin-4-one
CID 10313133
4-Amino-2-dimethylamino-6-hydroxypyrimidine
CID 135431314
2-Amino-1-methyl-1,4-dihydropyrimidin-4-one
CID 55281490
2-(ethylamino)-6-fluoro-1H-pyrimidin-4-one
CID 135506826
2-Butylamino-5-fluoro-3-methylpyrimidin-4(3h)-one
CID 129744055
Pyrimidine, 2-dimethylamino-1,6-dihydro-1-methyl-6-oxo-
CID 21854538
2-(Methylamino)-3,4-dihydropyrimidin-4-one
CID 14803475
3-Methyl-6-(methylamino)-4(3H)-pyrimidinone
CID 55288147

Frequently Asked Questions

What is the IUPAC name of 2-(ethenylamino)-3-methylpyrimidin-4-one?
The IUPAC name of 2-(ethenylamino)-3-methylpyrimidin-4-one (CID 89073017) is 2-(ethenylamino)-3-methylpyrimidin-4-one.
What is the SMILES notation for 2-(ethenylamino)-3-methylpyrimidin-4-one?
The canonical SMILES for 2-(ethenylamino)-3-methylpyrimidin-4-one is C=CNc1nccc(=O)n1C.
What is the InChIKey of 2-(ethenylamino)-3-methylpyrimidin-4-one?
The InChIKey is DISJMNIKJQZCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-3-8-7-9-5-4-6(11)10(7)2/h3-5H,1H2,2H3,(H,8,9).
What are the key properties of 2-(ethenylamino)-3-methylpyrimidin-4-one?
2-(ethenylamino)-3-methylpyrimidin-4-one has a molecular weight of 151.17 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethenylamino)-3-methylpyrimidin-4-one is sourced from PubChem (CID 89073017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).