[(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate

C17H27NO2Si — CID 134959204

IUPAC[(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate
SMILESCC(C)N(C(=O)O/C=C/[Si](C)(C)c1ccccc1)C(C)C
InChIInChI=1S/C17H27NO2Si/c1-14(2)18(15(3)4)17(19)20-12-13-21(5,6)16-10-8-7-9-11-16/h7-15H,1-6H3/b13-12+
InChIKeyKSGXUDLUHSDMPR-OUKQBFOZSA-N
MW305.49 g/mol
LogP3.91
Rot. Bonds5

About [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate

[(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate (PubChem CID 134959204) has the molecular formula C17H27NO2Si and a molecular weight of 305.49 g/mol. Its IUPAC name is [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate.

Molecular Properties

Compound Name[(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate
PubChem CID134959204
Molecular FormulaC17H27NO2Si
Molecular Weight305.49 g/mol
Exact Mass305.18
IUPAC Name[(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate
SMILESCC(C)N(C(=O)O/C=C/[Si](C)(C)c1ccccc1)C(C)C
InChIInChI=1S/C17H27NO2Si/c1-14(2)18(15(3)4)17(19)20-12-13-21(5,6)16-10-8-7-9-11-16/h7-15H,1-6H3/b13-12+
InChIKeyKSGXUDLUHSDMPR-OUKQBFOZSA-N
XLogP3.91
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.49
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate?
The IUPAC name of [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate (CID 134959204) is [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate.
What is the SMILES notation for [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate?
The canonical SMILES for [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate is CC(C)N(C(=O)O/C=C/[Si](C)(C)c1ccccc1)C(C)C.
What is the InChIKey of [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate?
The InChIKey is KSGXUDLUHSDMPR-OUKQBFOZSA-N. The full InChI is InChI=1S/C17H27NO2Si/c1-14(2)18(15(3)4)17(19)20-12-13-21(5,6)16-10-8-7-9-11-16/h7-15H,1-6H3/b13-12+.
What are the key properties of [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate?
[(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate has a molecular weight of 305.49 g/mol, XLogP of 3.91, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-[dimethyl(phenyl)silyl]ethenyl] N,N-di(propan-2-yl)carbamate is sourced from PubChem (CID 134959204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).