ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate

C13H21NO2Si — CID 71380165

IUPACethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate
SMILESCCOC(=O)N(c1ccc(C)cc1)[Si](C)(C)C
InChIInChI=1S/C13H21NO2Si/c1-6-16-13(15)14(17(3,4)5)12-9-7-11(2)8-10-12/h7-10H,6H2,1-5H3
InChIKeyAOJGERWIBSMKDS-UHFFFAOYSA-N
MW251.40 g/mol
LogP3.79
Rot. Bonds3

About ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate

ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate (PubChem CID 71380165) has the molecular formula C13H21NO2Si and a molecular weight of 251.40 g/mol. Its IUPAC name is ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate.

Molecular Properties

Compound Nameethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate
PubChem CID71380165
Molecular FormulaC13H21NO2Si
Molecular Weight251.40 g/mol
Exact Mass251.13
IUPAC Nameethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate
SMILESCCOC(=O)N(c1ccc(C)cc1)[Si](C)(C)C
InChIInChI=1S/C13H21NO2Si/c1-6-16-13(15)14(17(3,4)5)12-9-7-11(2)8-10-12/h7-10H,6H2,1-5H3
InChIKeyAOJGERWIBSMKDS-UHFFFAOYSA-N
XLogP3.79
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate
CID 71430344
ethyl N-carbamoyl-N-(4-methylphenyl)carbamate
CID 3044299
ethyl N-(3-bromo-2-oxopropyl)-N-(4-methylphenyl)carbamate
CID 104700951
ethyl N-(4-bromophenyl)-N-methylcarbamate
CID 131862849
ethyl N-methyl-N-(4-methylphenyl)sulfonylcarbamate
CID 12963006
diethyl 2-[2-(N,4-dimethylanilino)-2-oxoethyl]propanedioate
CID 135071381
ethyl N,N-bis(4-chlorophenyl)carbamate
CID 67612549
2-N,2-N,4-N,4-N,6-N,6-N-hexakis(4-methylphenyl)-1,3,5-triazine-2,4,6-triamine
CID 23557767
ethyl N-methyl-N-[4-[(4-methylphenyl)methylcarbamoylamino]phenyl]carbamate
CID 60568186
[4-[4-(acetyloxymethyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]methyl acetate
CID 59801354
methyl 3-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]propanoate
CID 91743844
[4-(N-[4-[4-(N-[4-(acetyloxymethyl)phenyl]-4-methylanilino)phenyl]phenyl]-4-methylanilino)phenyl]methyl acetate
CID 21360304

Frequently Asked Questions

What is the IUPAC name of ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate?
The IUPAC name of ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate (CID 71380165) is ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate.
What is the SMILES notation for ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate?
The canonical SMILES for ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate is CCOC(=O)N(c1ccc(C)cc1)[Si](C)(C)C.
What is the InChIKey of ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate?
The InChIKey is AOJGERWIBSMKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2Si/c1-6-16-13(15)14(17(3,4)5)12-9-7-11(2)8-10-12/h7-10H,6H2,1-5H3.
What are the key properties of ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate?
ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate has a molecular weight of 251.40 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(4-methylphenyl)-N-trimethylsilylcarbamate is sourced from PubChem (CID 71380165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).