1,3-dimethyl-1,3-diazinane-2,4-dione

C6H10N2O2 — CID 588295

IUPAC1,3-dimethyl-1,3-diazinane-2,4-dione
SMILESCN1CCC(=O)N(C)C1=O
InChIInChI=1S/C6H10N2O2/c1-7-4-3-5(9)8(2)6(7)10/h3-4H2,1-2H3
InChIKeyBVYOHIBNWMCUSW-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.10
Rot. Bonds

About 1,3-dimethyl-1,3-diazinane-2,4-dione

1,3-dimethyl-1,3-diazinane-2,4-dione (PubChem CID 588295) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 1,3-dimethyl-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-1,3-diazinane-2,4-dione
PubChem CID588295
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name1,3-dimethyl-1,3-diazinane-2,4-dione
SMILESCN1CCC(=O)N(C)C1=O
InChIInChI=1S/C6H10N2O2/c1-7-4-3-5(9)8(2)6(7)10/h3-4H2,1-2H3
InChIKeyBVYOHIBNWMCUSW-UHFFFAOYSA-N
XLogP-0.10
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Dimethylbarbituric acid
CID 69860
Hydrouracil, 1-methyl-
CID 237963
5,5-Dimethyldihydropyrimidine-2,4(1H,3H)-dione
CID 21263987
1,3,5-Trimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
CID 81820
1-(Propan-2-yl)-1,3-diazinane-2,4-dione
CID 253730
1,3-Dipropylpyrimidine-2,4,6(1H,3H,5H)-trione
CID 12470916
1-Butyldihydropyrimidine-2,4(1h,3h)-dione
CID 243297
1,3-Diethylbarbituric acid
CID 122889
1-Ethyl-1,3-diazinane-2,4,6-trione
CID 257087
1-Ethyldihydro-2,4(1H,3H)-pyrimidinedione
CID 4164670
1,5,5-Trimethylpyrimidine-2,4,6(1h,3h,5h)-trione
CID 231279
1,3-Dichloro-1,3-diazinane-2,4-dione
CID 352495

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-1,3-diazinane-2,4-dione?
The IUPAC name of 1,3-dimethyl-1,3-diazinane-2,4-dione (CID 588295) is 1,3-dimethyl-1,3-diazinane-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-1,3-diazinane-2,4-dione?
The canonical SMILES for 1,3-dimethyl-1,3-diazinane-2,4-dione is CN1CCC(=O)N(C)C1=O.
What is the InChIKey of 1,3-dimethyl-1,3-diazinane-2,4-dione?
The InChIKey is BVYOHIBNWMCUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-7-4-3-5(9)8(2)6(7)10/h3-4H2,1-2H3.
What are the key properties of 1,3-dimethyl-1,3-diazinane-2,4-dione?
1,3-dimethyl-1,3-diazinane-2,4-dione has a molecular weight of 142.16 g/mol, XLogP of -0.10, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-1,3-diazinane-2,4-dione is sourced from PubChem (CID 588295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).