5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione

C17H32N2O3Si2 — CID 631820

IUPAC5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione
SMILESC=CCC1(CC(C)C)C(=O)N([Si](C)(C)C)C(=O)N([Si](C)(C)C)C1=O
InChIInChI=1S/C17H32N2O3Si2/c1-10-11-17(12-13(2)3)14(20)18(23(4,5)6)16(22)19(15(17)21)24(7,8)9/h10,13H,1,11-12H2,2-9H3
InChIKeyFCSOKCNDOOWRJV-UHFFFAOYSA-N
MW368.63 g/mol
LogP4.06
Rot. Bonds6

About 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione

5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione (PubChem CID 631820) has the molecular formula C17H32N2O3Si2 and a molecular weight of 368.63 g/mol. Its IUPAC name is 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione.

Molecular Properties

Compound Name5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione
PubChem CID631820
Molecular FormulaC17H32N2O3Si2
Molecular Weight368.63 g/mol
Exact Mass368.20
IUPAC Name5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione
SMILESC=CCC1(CC(C)C)C(=O)N([Si](C)(C)C)C(=O)N([Si](C)(C)C)C1=O
InChIInChI=1S/C17H32N2O3Si2/c1-10-11-17(12-13(2)3)14(20)18(23(4,5)6)16(22)19(15(17)21)24(7,8)9/h10,13H,1,11-12H2,2-9H3
InChIKeyFCSOKCNDOOWRJV-UHFFFAOYSA-N
XLogP4.06
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.63
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione?
The IUPAC name of 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione (CID 631820) is 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione.
What is the SMILES notation for 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione?
The canonical SMILES for 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione is C=CCC1(CC(C)C)C(=O)N([Si](C)(C)C)C(=O)N([Si](C)(C)C)C1=O.
What is the InChIKey of 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione?
The InChIKey is FCSOKCNDOOWRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O3Si2/c1-10-11-17(12-13(2)3)14(20)18(23(4,5)6)16(22)19(15(17)21)24(7,8)9/h10,13H,1,11-12H2,2-9H3.
What are the key properties of 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione?
5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione has a molecular weight of 368.63 g/mol, XLogP of 4.06, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-5-prop-2-enyl-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione is sourced from PubChem (CID 631820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).