sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione

C7H11N2NaO3 — CID 173035286

IUPACsodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione
SMILESCC1C(=O)N(C)C(=O)N(C)C1=O.[H-].[Na+]
InChIInChI=1S/C7H10N2O3.Na.H/c1-4-5(10)8(2)7(12)9(3)6(4)11;;/h4H,1-3H3;;/q;+1;-1
InChIKeyZWLCIISQYBTWOM-UHFFFAOYSA-N
MW194.17 g/mol
LogP-3.21
Rot. Bonds

About sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione

sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione (PubChem CID 173035286) has the molecular formula C7H11N2NaO3 and a molecular weight of 194.17 g/mol. Its IUPAC name is sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione.

Molecular Properties

Compound Namesodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione
PubChem CID173035286
Molecular FormulaC7H11N2NaO3
Molecular Weight194.17 g/mol
Exact Mass194.07
IUPAC Namesodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione
SMILESCC1C(=O)N(C)C(=O)N(C)C1=O.[H-].[Na+]
InChIInChI=1S/C7H10N2O3.Na.H/c1-4-5(10)8(2)7(12)9(3)6(4)11;;/h4H,1-3H3;;/q;+1;-1
InChIKeyZWLCIISQYBTWOM-UHFFFAOYSA-N
XLogP-3.21
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.17
LogP ≤ 5-3.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione?
The IUPAC name of sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione (CID 173035286) is sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione.
What is the SMILES notation for sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione?
The canonical SMILES for sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione is CC1C(=O)N(C)C(=O)N(C)C1=O.[H-].[Na+].
What is the InChIKey of sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione?
The InChIKey is ZWLCIISQYBTWOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3.Na.H/c1-4-5(10)8(2)7(12)9(3)6(4)11;;/h4H,1-3H3;;/q;+1;-1.
What are the key properties of sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione?
sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione has a molecular weight of 194.17 g/mol, XLogP of -3.21, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;1,3,5-trimethyl-1,3-diazinane-2,4,6-trione is sourced from PubChem (CID 173035286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).