1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one

C12H26N2O2Si — CID 140927699

IUPAC1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one
SMILESCC(C)(C)[Si](C)(C)OCCN1CCCNC1=O
InChIInChI=1S/C12H26N2O2Si/c1-12(2,3)17(4,5)16-10-9-14-8-6-7-13-11(14)15/h6-10H2,1-5H3,(H,13,15)
InChIKeyVSWFZOBTYAHRBN-UHFFFAOYSA-N
MW258.44 g/mol
LogP2.42
Rot. Bonds4

About 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one

1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one (PubChem CID 140927699) has the molecular formula C12H26N2O2Si and a molecular weight of 258.44 g/mol. Its IUPAC name is 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one.

Molecular Properties

Compound Name1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one
PubChem CID140927699
Molecular FormulaC12H26N2O2Si
Molecular Weight258.44 g/mol
Exact Mass258.18
IUPAC Name1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one
SMILESCC(C)(C)[Si](C)(C)OCCN1CCCNC1=O
InChIInChI=1S/C12H26N2O2Si/c1-12(2,3)17(4,5)16-10-9-14-8-6-7-13-11(14)15/h6-10H2,1-5H3,(H,13,15)
InChIKeyVSWFZOBTYAHRBN-UHFFFAOYSA-N
XLogP2.42
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.44
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperidin-2-one
CID 58604092
(3S)-3-amino-1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperidin-2-one
CID 141190377
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidin-2-one
CID 130395908
1-(2-methylsulfanylethyl)-1,3-diazinan-2-one
CID 115371185
3-bromo-1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]piperidin-2-one
CID 23114648
1-ethyl-1,3-diazinan-2-one
CID 21479220
butyl 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-oxopiperazine-2-carboxylate
CID 69465772
1-[2-(2-methylpyrazol-3-yl)ethyl]-1,3-diazinan-2-one
CID 103012757
1-(3,3-diethoxypropyl)-1,3-diazinan-2-one
CID 69224786
1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168713516
3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one
CID 11608751
1-butyl-1,3-diazepan-2-one
CID 150099536

Frequently Asked Questions

What is the IUPAC name of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one?
The IUPAC name of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one (CID 140927699) is 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one.
What is the SMILES notation for 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one?
The canonical SMILES for 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one is CC(C)(C)[Si](C)(C)OCCN1CCCNC1=O.
What is the InChIKey of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one?
The InChIKey is VSWFZOBTYAHRBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2Si/c1-12(2,3)17(4,5)16-10-9-14-8-6-7-13-11(14)15/h6-10H2,1-5H3,(H,13,15).
What are the key properties of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one?
1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one has a molecular weight of 258.44 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one is sourced from PubChem (CID 140927699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).