1-methyl-6-methylidene-1,3-diazinan-4-one

C6H10N2O — CID 143917902

IUPAC1-methyl-6-methylidene-1,3-diazinan-4-one
SMILESC=C1CC(=O)NCN1C
InChIInChI=1S/C6H10N2O/c1-5-3-6(9)7-4-8(5)2/h1,3-4H2,2H3,(H,7,9)
InChIKeyZXEDAWIVYARUET-UHFFFAOYSA-N
MW126.16 g/mol
LogP-0.09
Rot. Bonds

About 1-methyl-6-methylidene-1,3-diazinan-4-one

1-methyl-6-methylidene-1,3-diazinan-4-one (PubChem CID 143917902) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 1-methyl-6-methylidene-1,3-diazinan-4-one.

Molecular Properties

Compound Name1-methyl-6-methylidene-1,3-diazinan-4-one
PubChem CID143917902
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name1-methyl-6-methylidene-1,3-diazinan-4-one
SMILESC=C1CC(=O)NCN1C
InChIInChI=1S/C6H10N2O/c1-5-3-6(9)7-4-8(5)2/h1,3-4H2,2H3,(H,7,9)
InChIKeyZXEDAWIVYARUET-UHFFFAOYSA-N
XLogP-0.09
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Dimethyl-6-methylidene-1,3-diazinane-2,4-dione
CID 54123646
2,6-Dimethylidene-1,3-diazinan-4-one
CID 59889553
6-Methylidene-1,3-diazinan-4-one
CID 121369904
1,3-Dimethyl-2,6-dimethylidene-1,3-diazinan-4-one
CID 130281940
1-Methyl-6-methylidene-1,3-diazinane-2,4-dione
CID 143328426
1-Methyl-6-methylidene-1,3-diazinan-2-one
CID 156102618
2-Methyl-1,2,3,4a,5,6-hexahydropyrrolo[3,4-d]pyrimidin-4-one
CID 164000537
ethane;1-[(E)-1-(ethenylamino)but-1-en-2-yl]-1,3-diazinane-2,4-dione
CID 171565175
2,2-Dimethyl-6-methylidene-1,3-diazinan-4-one
CID 153104760
3-Methyl-6-methylidene-1,3-diazinane-2,4-dione
CID 160554599
6-Methylidene-1-propan-2-yl-1,3-diazinane-2,4-dione
CID 161088870
6-Methylidene-1-propan-2-yl-1,3-diazinan-4-one
CID 161088871

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-methylidene-1,3-diazinan-4-one?
The IUPAC name of 1-methyl-6-methylidene-1,3-diazinan-4-one (CID 143917902) is 1-methyl-6-methylidene-1,3-diazinan-4-one.
What is the SMILES notation for 1-methyl-6-methylidene-1,3-diazinan-4-one?
The canonical SMILES for 1-methyl-6-methylidene-1,3-diazinan-4-one is C=C1CC(=O)NCN1C.
What is the InChIKey of 1-methyl-6-methylidene-1,3-diazinan-4-one?
The InChIKey is ZXEDAWIVYARUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-5-3-6(9)7-4-8(5)2/h1,3-4H2,2H3,(H,7,9).
What are the key properties of 1-methyl-6-methylidene-1,3-diazinan-4-one?
1-methyl-6-methylidene-1,3-diazinan-4-one has a molecular weight of 126.16 g/mol, XLogP of -0.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-methylidene-1,3-diazinan-4-one is sourced from PubChem (CID 143917902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).