(4-methoxyphenyl) N-phenylcarbamate

C14H13NO3 — CID 29508

IUPAC(4-methoxyphenyl) N-phenylcarbamate
SMILESCOc1ccc(OC(=O)Nc2ccccc2)cc1
InChIInChI=1S/C14H13NO3/c1-17-12-7-9-13(10-8-12)18-14(16)15-11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16)
InChIKeyOKZNBJVONJHCEP-UHFFFAOYSA-N
MW243.26 g/mol
LogP3.31
Rot. Bonds3

About (4-methoxyphenyl) N-phenylcarbamate

(4-methoxyphenyl) N-phenylcarbamate (PubChem CID 29508) has the molecular formula C14H13NO3 and a molecular weight of 243.26 g/mol. Its IUPAC name is (4-methoxyphenyl) N-phenylcarbamate.

Molecular Properties

Compound Name(4-methoxyphenyl) N-phenylcarbamate
PubChem CID29508
Molecular FormulaC14H13NO3
Molecular Weight243.26 g/mol
Exact Mass243.09
IUPAC Name(4-methoxyphenyl) N-phenylcarbamate
SMILESCOc1ccc(OC(=O)Nc2ccccc2)cc1
InChIInChI=1S/C14H13NO3/c1-17-12-7-9-13(10-8-12)18-14(16)15-11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16)
InChIKeyOKZNBJVONJHCEP-UHFFFAOYSA-N
XLogP3.31
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl) N-phenylcarbamate?
The IUPAC name of (4-methoxyphenyl) N-phenylcarbamate (CID 29508) is (4-methoxyphenyl) N-phenylcarbamate.
What is the SMILES notation for (4-methoxyphenyl) N-phenylcarbamate?
The canonical SMILES for (4-methoxyphenyl) N-phenylcarbamate is COc1ccc(OC(=O)Nc2ccccc2)cc1.
What is the InChIKey of (4-methoxyphenyl) N-phenylcarbamate?
The InChIKey is OKZNBJVONJHCEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO3/c1-17-12-7-9-13(10-8-12)18-14(16)15-11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16).
What are the key properties of (4-methoxyphenyl) N-phenylcarbamate?
(4-methoxyphenyl) N-phenylcarbamate has a molecular weight of 243.26 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl) N-phenylcarbamate is sourced from PubChem (CID 29508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).