phenyl N-(4-acetylphenyl)carbamate

C15H13NO3 — CID 806009

IUPACphenyl N-(4-acetylphenyl)carbamate
SMILESCC(=O)c1ccc(NC(=O)Oc2ccccc2)cc1
InChIInChI=1S/C15H13NO3/c1-11(17)12-7-9-13(10-8-12)16-15(18)19-14-5-3-2-4-6-14/h2-10H,1H3,(H,16,18)
InChIKeyLETGZXPZNAIRNJ-UHFFFAOYSA-N
MW255.27 g/mol
LogP3.50
Rot. Bonds3

About phenyl N-(4-acetylphenyl)carbamate

phenyl N-(4-acetylphenyl)carbamate (PubChem CID 806009) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is phenyl N-(4-acetylphenyl)carbamate.

Molecular Properties

Compound Namephenyl N-(4-acetylphenyl)carbamate
PubChem CID806009
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Namephenyl N-(4-acetylphenyl)carbamate
SMILESCC(=O)c1ccc(NC(=O)Oc2ccccc2)cc1
InChIInChI=1S/C15H13NO3/c1-11(17)12-7-9-13(10-8-12)16-15(18)19-14-5-3-2-4-6-14/h2-10H,1H3,(H,16,18)
InChIKeyLETGZXPZNAIRNJ-UHFFFAOYSA-N
XLogP3.50
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of phenyl N-(4-acetylphenyl)carbamate?
The IUPAC name of phenyl N-(4-acetylphenyl)carbamate (CID 806009) is phenyl N-(4-acetylphenyl)carbamate.
What is the SMILES notation for phenyl N-(4-acetylphenyl)carbamate?
The canonical SMILES for phenyl N-(4-acetylphenyl)carbamate is CC(=O)c1ccc(NC(=O)Oc2ccccc2)cc1.
What is the InChIKey of phenyl N-(4-acetylphenyl)carbamate?
The InChIKey is LETGZXPZNAIRNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c1-11(17)12-7-9-13(10-8-12)16-15(18)19-14-5-3-2-4-6-14/h2-10H,1H3,(H,16,18).
What are the key properties of phenyl N-(4-acetylphenyl)carbamate?
phenyl N-(4-acetylphenyl)carbamate has a molecular weight of 255.27 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(4-acetylphenyl)carbamate is sourced from PubChem (CID 806009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).