tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate

C11H25NO3Si — CID 173045838

IUPACtert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate
SMILESC[SiH](C)N(OC(C)(C)C)C(=O)OC(C)(C)C
InChIInChI=1S/C11H25NO3Si/c1-10(2,3)14-9(13)12(16(7)8)15-11(4,5)6/h16H,1-8H3
InChIKeyOKIBGOUWDSQNPF-UHFFFAOYSA-N
MW247.41 g/mol
LogP2.94
Rot. Bonds2

About tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate

tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate (PubChem CID 173045838) has the molecular formula C11H25NO3Si and a molecular weight of 247.41 g/mol. Its IUPAC name is tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate.

Molecular Properties

Compound Nametert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate
PubChem CID173045838
Molecular FormulaC11H25NO3Si
Molecular Weight247.41 g/mol
Exact Mass247.16
IUPAC Nametert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate
SMILESC[SiH](C)N(OC(C)(C)C)C(=O)OC(C)(C)C
InChIInChI=1S/C11H25NO3Si/c1-10(2,3)14-9(13)12(16(7)8)15-11(4,5)6/h16H,1-8H3
InChIKeyOKIBGOUWDSQNPF-UHFFFAOYSA-N
XLogP2.94
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.41
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl N-[1,1-bis[fluoro-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-N-fluorocarbamate
CID 57014425
tert-butyl N-carbamoyl-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 135140582
tert-butyl acetate
CID 159704758
tert-butyl N-acetyl-N-methylcarbamate
CID 11052126
tert-butyl N-hydroxy-N-(3-hydroxypropyl)carbamate
CID 86028321
sodium tert-butyl acetate
CID 22391906
tert-butyl acetate;iron
CID 174907269
tert-butyl N-methyl-N-(methylamino)carbamate
CID 10678541
2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pentanoic acid
CID 175182168
1-[2-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]cyclopropane-1-carboxylic acid
CID 84813407
tert-butyl N-dodecyl-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 89457667
tert-butyl N-methyl-N-(2,3,4,5,6-pentafluorophenyl)carbamate
CID 172558948

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate?
The IUPAC name of tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate (CID 173045838) is tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate.
What is the SMILES notation for tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate?
The canonical SMILES for tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate is C[SiH](C)N(OC(C)(C)C)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate?
The InChIKey is OKIBGOUWDSQNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3Si/c1-10(2,3)14-9(13)12(16(7)8)15-11(4,5)6/h16H,1-8H3.
What are the key properties of tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate?
tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate has a molecular weight of 247.41 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-dimethylsilyl-N-[(2-methylpropan-2-yl)oxy]carbamate is sourced from PubChem (CID 173045838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).