6-methylidene-1,3-diazinane-2,4-dione;piperazine

C9H16N4O2 — CID 159527951

IUPAC6-methylidene-1,3-diazinane-2,4-dione;piperazine
SMILESC1CNCCN1.C=C1CC(=O)NC(=O)N1
InChIInChI=1S/C5H6N2O2.C4H10N2/c1-3-2-4(8)7-5(9)6-3;1-2-6-4-3-5-1/h1-2H2,(H2,6,7,8,9);5-6H,1-4H2
InChIKeyMCPSJFUVSRLZQE-UHFFFAOYSA-N
MW212.25 g/mol
LogP-1.09
Rot. Bonds

About 6-methylidene-1,3-diazinane-2,4-dione;piperazine

6-methylidene-1,3-diazinane-2,4-dione;piperazine (PubChem CID 159527951) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 6-methylidene-1,3-diazinane-2,4-dione;piperazine.

Molecular Properties

Compound Name6-methylidene-1,3-diazinane-2,4-dione;piperazine
PubChem CID159527951
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name6-methylidene-1,3-diazinane-2,4-dione;piperazine
SMILESC1CNCCN1.C=C1CC(=O)NC(=O)N1
InChIInChI=1S/C5H6N2O2.C4H10N2/c1-3-2-4(8)7-5(9)6-3;1-2-6-4-3-5-1/h1-2H2,(H2,6,7,8,9);5-6H,1-4H2
InChIKeyMCPSJFUVSRLZQE-UHFFFAOYSA-N
XLogP-1.09
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-1.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

6-Methylidene-1,3-diazinane-2,4-dione;1,3,5-triazinane-2,4,6-trione
CID 159488382
1,3-Dimethyl-1,3-diazinane-2,4,6-trione;3-methyl-6-methylidene-1,3-diazinane-2,4-dione
CID 160554598
1,3-Dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one
CID 82511043

Frequently Asked Questions

What is the IUPAC name of 6-methylidene-1,3-diazinane-2,4-dione;piperazine?
The IUPAC name of 6-methylidene-1,3-diazinane-2,4-dione;piperazine (CID 159527951) is 6-methylidene-1,3-diazinane-2,4-dione;piperazine.
What is the SMILES notation for 6-methylidene-1,3-diazinane-2,4-dione;piperazine?
The canonical SMILES for 6-methylidene-1,3-diazinane-2,4-dione;piperazine is C1CNCCN1.C=C1CC(=O)NC(=O)N1.
What is the InChIKey of 6-methylidene-1,3-diazinane-2,4-dione;piperazine?
The InChIKey is MCPSJFUVSRLZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2.C4H10N2/c1-3-2-4(8)7-5(9)6-3;1-2-6-4-3-5-1/h1-2H2,(H2,6,7,8,9);5-6H,1-4H2.
What are the key properties of 6-methylidene-1,3-diazinane-2,4-dione;piperazine?
6-methylidene-1,3-diazinane-2,4-dione;piperazine has a molecular weight of 212.25 g/mol, XLogP of -1.09, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-1,3-diazinane-2,4-dione;piperazine is sourced from PubChem (CID 159527951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).