phenyl N-(2-ethoxyphenyl)carbamate

C15H15NO3 — CID 51345560

IUPACphenyl N-(2-ethoxyphenyl)carbamate
SMILESCCOc1ccccc1NC(=O)Oc1ccccc1
InChIInChI=1S/C15H15NO3/c1-2-18-14-11-7-6-10-13(14)16-15(17)19-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,16,17)
InChIKeyQDMMFYYESFCHDI-UHFFFAOYSA-N
MW257.29 g/mol
LogP3.70
Rot. Bonds4

About phenyl N-(2-ethoxyphenyl)carbamate

phenyl N-(2-ethoxyphenyl)carbamate (PubChem CID 51345560) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is phenyl N-(2-ethoxyphenyl)carbamate.

Molecular Properties

Compound Namephenyl N-(2-ethoxyphenyl)carbamate
PubChem CID51345560
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Namephenyl N-(2-ethoxyphenyl)carbamate
SMILESCCOc1ccccc1NC(=O)Oc1ccccc1
InChIInChI=1S/C15H15NO3/c1-2-18-14-11-7-6-10-13(14)16-15(17)19-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,16,17)
InChIKeyQDMMFYYESFCHDI-UHFFFAOYSA-N
XLogP3.70
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of phenyl N-(2-ethoxyphenyl)carbamate?
The IUPAC name of phenyl N-(2-ethoxyphenyl)carbamate (CID 51345560) is phenyl N-(2-ethoxyphenyl)carbamate.
What is the SMILES notation for phenyl N-(2-ethoxyphenyl)carbamate?
The canonical SMILES for phenyl N-(2-ethoxyphenyl)carbamate is CCOc1ccccc1NC(=O)Oc1ccccc1.
What is the InChIKey of phenyl N-(2-ethoxyphenyl)carbamate?
The InChIKey is QDMMFYYESFCHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-2-18-14-11-7-6-10-13(14)16-15(17)19-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,16,17).
What are the key properties of phenyl N-(2-ethoxyphenyl)carbamate?
phenyl N-(2-ethoxyphenyl)carbamate has a molecular weight of 257.29 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(2-ethoxyphenyl)carbamate is sourced from PubChem (CID 51345560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).