tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate

C17H32N2O2Si2 — CID 91696900

IUPACtert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate
SMILESCC(C)(C)OC(=O)N(c1ccccc1N[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H32N2O2Si2/c1-17(2,3)21-16(20)19(23(7,8)9)15-13-11-10-12-14(15)18-22(4,5)6/h10-13,18H,1-9H3
InChIKeyUCVPYQOHHCFCPQ-UHFFFAOYSA-N
MW352.63 g/mol
LogP5.51
Rot. Bonds4

About tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate

tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate (PubChem CID 91696900) has the molecular formula C17H32N2O2Si2 and a molecular weight of 352.63 g/mol. Its IUPAC name is tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate
PubChem CID91696900
Molecular FormulaC17H32N2O2Si2
Molecular Weight352.63 g/mol
Exact Mass352.20
IUPAC Nametert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate
SMILESCC(C)(C)OC(=O)N(c1ccccc1N[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H32N2O2Si2/c1-17(2,3)21-16(20)19(23(7,8)9)15-13-11-10-12-14(15)18-22(4,5)6/h10-13,18H,1-9H3
InChIKeyUCVPYQOHHCFCPQ-UHFFFAOYSA-N
XLogP5.51
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.63
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate?
The IUPAC name of tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate (CID 91696900) is tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate.
What is the SMILES notation for tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate?
The canonical SMILES for tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate is CC(C)(C)OC(=O)N(c1ccccc1N[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate?
The InChIKey is UCVPYQOHHCFCPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2Si2/c1-17(2,3)21-16(20)19(23(7,8)9)15-13-11-10-12-14(15)18-22(4,5)6/h10-13,18H,1-9H3.
What are the key properties of tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate?
tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate has a molecular weight of 352.63 g/mol, XLogP of 5.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-trimethylsilyl-N-[2-(trimethylsilylamino)phenyl]carbamate is sourced from PubChem (CID 91696900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).