ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate

C18H23NO2Si — CID 71430344

IUPACethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate
SMILESCCOC(=O)N(c1ccccc1)[Si](C)(C)c1ccc(C)cc1
InChIInChI=1S/C18H23NO2Si/c1-5-21-18(20)19(16-9-7-6-8-10-16)22(3,4)17-13-11-15(2)12-14-17/h6-14H,5H2,1-4H3
InChIKeyDTQPJGFIDBHCPY-UHFFFAOYSA-N
MW313.47 g/mol
LogP4.07
Rot. Bonds4

About ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate

ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate (PubChem CID 71430344) has the molecular formula C18H23NO2Si and a molecular weight of 313.47 g/mol. Its IUPAC name is ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate.

Molecular Properties

Compound Nameethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate
PubChem CID71430344
Molecular FormulaC18H23NO2Si
Molecular Weight313.47 g/mol
Exact Mass313.15
IUPAC Nameethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate
SMILESCCOC(=O)N(c1ccccc1)[Si](C)(C)c1ccc(C)cc1
InChIInChI=1S/C18H23NO2Si/c1-5-21-18(20)19(16-9-7-6-8-10-16)22(3,4)17-13-11-15(2)12-14-17/h6-14H,5H2,1-4H3
InChIKeyDTQPJGFIDBHCPY-UHFFFAOYSA-N
XLogP4.07
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.47
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate?
The IUPAC name of ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate (CID 71430344) is ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate.
What is the SMILES notation for ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate?
The canonical SMILES for ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate is CCOC(=O)N(c1ccccc1)[Si](C)(C)c1ccc(C)cc1.
What is the InChIKey of ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate?
The InChIKey is DTQPJGFIDBHCPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2Si/c1-5-21-18(20)19(16-9-7-6-8-10-16)22(3,4)17-13-11-15(2)12-14-17/h6-14H,5H2,1-4H3.
What are the key properties of ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate?
ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate has a molecular weight of 313.47 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[dimethyl-(4-methylphenyl)silyl]-N-phenylcarbamate is sourced from PubChem (CID 71430344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).