ethyl N-ethyl-N-phenylcarbamate

C11H15NO2 — CID 13901

IUPACethyl N-ethyl-N-phenylcarbamate
SMILESCCOC(=O)N(CC)c1ccccc1
InChIInChI=1S/C11H15NO2/c1-3-12(11(13)14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
InChIKeyXEFYPTRGVWLMHB-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.67
Rot. Bonds3

About ethyl N-ethyl-N-phenylcarbamate

ethyl N-ethyl-N-phenylcarbamate (PubChem CID 13901) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is ethyl N-ethyl-N-phenylcarbamate.

Molecular Properties

Compound Nameethyl N-ethyl-N-phenylcarbamate
PubChem CID13901
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Nameethyl N-ethyl-N-phenylcarbamate
SMILESCCOC(=O)N(CC)c1ccccc1
InChIInChI=1S/C11H15NO2/c1-3-12(11(13)14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
InChIKeyXEFYPTRGVWLMHB-UHFFFAOYSA-N
XLogP2.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethyl N-ethyl-N-phenylcarbamate?
The IUPAC name of ethyl N-ethyl-N-phenylcarbamate (CID 13901) is ethyl N-ethyl-N-phenylcarbamate.
What is the SMILES notation for ethyl N-ethyl-N-phenylcarbamate?
The canonical SMILES for ethyl N-ethyl-N-phenylcarbamate is CCOC(=O)N(CC)c1ccccc1.
What is the InChIKey of ethyl N-ethyl-N-phenylcarbamate?
The InChIKey is XEFYPTRGVWLMHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-3-12(11(13)14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3.
What are the key properties of ethyl N-ethyl-N-phenylcarbamate?
ethyl N-ethyl-N-phenylcarbamate has a molecular weight of 193.25 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-ethyl-N-phenylcarbamate is sourced from PubChem (CID 13901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).