lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate

C13H26LiNO2Si — CID 134889525

IUPAClithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate
SMILESCC(C)N(C(=O)O[CH-]/C=C/[Si](C)(C)C)C(C)C.[Li+]
InChIInChI=1S/C13H26NO2Si.Li/c1-11(2)14(12(3)4)13(15)16-9-8-10-17(5,6)7;/h8-12H,1-7H3;/q-1;+1/b10-8+;
InChIKeyWZVDWDYJQRACMT-VRTOBVRTSA-N
MW263.38 g/mol
LogP0.84
Rot. Bonds5

About lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate

lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate (PubChem CID 134889525) has the molecular formula C13H26LiNO2Si and a molecular weight of 263.38 g/mol. Its IUPAC name is lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate.

Molecular Properties

Compound Namelithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate
PubChem CID134889525
Molecular FormulaC13H26LiNO2Si
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Namelithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate
SMILESCC(C)N(C(=O)O[CH-]/C=C/[Si](C)(C)C)C(C)C.[Li+]
InChIInChI=1S/C13H26NO2Si.Li/c1-11(2)14(12(3)4)13(15)16-9-8-10-17(5,6)7;/h8-12H,1-7H3;/q-1;+1/b10-8+;
InChIKeyWZVDWDYJQRACMT-VRTOBVRTSA-N
XLogP0.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

prop-2-enyl N,N-di(propan-2-yl)carbamate
CID 11275447
lithium [(E)-but-2-enyl] N,N-di(propan-2-yl)carbamate
CID 12901922
2-(trimethylsilylmethyl)prop-2-enyl N,N-di(propan-2-yl)carbamate
CID 11323223
[(E)-1-trimethylsilylbut-2-enyl] N,N-di(propan-2-yl)carbamate
CID 13329872
[(Z)-1-trimethylsilylbut-2-enyl] N,N-di(propan-2-yl)carbamate
CID 13329873
[(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate
CID 13436523
1-trimethylsilylprop-2-enyl N,N-di(propan-2-yl)carbamate
CID 13459260
lithium [(E)-1-trimethylsilylbut-2-enyl] N,N-di(propan-2-yl)carbamate
CID 177525050

Frequently Asked Questions

What is the IUPAC name of lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate?
The IUPAC name of lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate (CID 134889525) is lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate.
What is the SMILES notation for lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate?
The canonical SMILES for lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate is CC(C)N(C(=O)O[CH-]/C=C/[Si](C)(C)C)C(C)C.[Li+].
What is the InChIKey of lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate?
The InChIKey is WZVDWDYJQRACMT-VRTOBVRTSA-N. The full InChI is InChI=1S/C13H26NO2Si.Li/c1-11(2)14(12(3)4)13(15)16-9-8-10-17(5,6)7;/h8-12H,1-7H3;/q-1;+1/b10-8+;.
What are the key properties of lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate?
lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate has a molecular weight of 263.38 g/mol, XLogP of 0.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium [(E)-3-trimethylsilylprop-2-enyl] N,N-di(propan-2-yl)carbamate is sourced from PubChem (CID 134889525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).