(3,5-dimethoxyphenyl) N-phenylcarbamate

C15H15NO4 — CID 23281948

IUPAC(3,5-dimethoxyphenyl) N-phenylcarbamate
SMILESCOc1cc(OC)cc(OC(=O)Nc2ccccc2)c1
InChIInChI=1S/C15H15NO4/c1-18-12-8-13(19-2)10-14(9-12)20-15(17)16-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,16,17)
InChIKeyJEOFHEXHEDYBSN-UHFFFAOYSA-N
MW273.29 g/mol
LogP3.31
Rot. Bonds4

About (3,5-dimethoxyphenyl) N-phenylcarbamate

(3,5-dimethoxyphenyl) N-phenylcarbamate (PubChem CID 23281948) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is (3,5-dimethoxyphenyl) N-phenylcarbamate.

Molecular Properties

Compound Name(3,5-dimethoxyphenyl) N-phenylcarbamate
PubChem CID23281948
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name(3,5-dimethoxyphenyl) N-phenylcarbamate
SMILESCOc1cc(OC)cc(OC(=O)Nc2ccccc2)c1
InChIInChI=1S/C15H15NO4/c1-18-12-8-13(19-2)10-14(9-12)20-15(17)16-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,16,17)
InChIKeyJEOFHEXHEDYBSN-UHFFFAOYSA-N
XLogP3.31
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxyphenyl) N-phenylcarbamate?
The IUPAC name of (3,5-dimethoxyphenyl) N-phenylcarbamate (CID 23281948) is (3,5-dimethoxyphenyl) N-phenylcarbamate.
What is the SMILES notation for (3,5-dimethoxyphenyl) N-phenylcarbamate?
The canonical SMILES for (3,5-dimethoxyphenyl) N-phenylcarbamate is COc1cc(OC)cc(OC(=O)Nc2ccccc2)c1.
What is the InChIKey of (3,5-dimethoxyphenyl) N-phenylcarbamate?
The InChIKey is JEOFHEXHEDYBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c1-18-12-8-13(19-2)10-14(9-12)20-15(17)16-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,16,17).
What are the key properties of (3,5-dimethoxyphenyl) N-phenylcarbamate?
(3,5-dimethoxyphenyl) N-phenylcarbamate has a molecular weight of 273.29 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxyphenyl) N-phenylcarbamate is sourced from PubChem (CID 23281948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).