(2-methylphenyl) N-benzoylcarbamate

C15H13NO3 — CID 2297773

IUPAC(2-methylphenyl) N-benzoylcarbamate
SMILESCc1ccccc1OC(=O)NC(=O)c1ccccc1
InChIInChI=1S/C15H13NO3/c1-11-7-5-6-10-13(11)19-15(18)16-14(17)12-8-3-2-4-9-12/h2-10H,1H3,(H,16,17,18)
InChIKeyFNXPXYKWCLGYJE-UHFFFAOYSA-N
MW255.27 g/mol
LogP2.92
Rot. Bonds2

About (2-methylphenyl) N-benzoylcarbamate

(2-methylphenyl) N-benzoylcarbamate (PubChem CID 2297773) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is (2-methylphenyl) N-benzoylcarbamate.

Molecular Properties

Compound Name(2-methylphenyl) N-benzoylcarbamate
PubChem CID2297773
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Name(2-methylphenyl) N-benzoylcarbamate
SMILESCc1ccccc1OC(=O)NC(=O)c1ccccc1
InChIInChI=1S/C15H13NO3/c1-11-7-5-6-10-13(11)19-15(18)16-14(17)12-8-3-2-4-9-12/h2-10H,1H3,(H,16,17,18)
InChIKeyFNXPXYKWCLGYJE-UHFFFAOYSA-N
XLogP2.92
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methylphenyl) N-benzoylcarbamate?
The IUPAC name of (2-methylphenyl) N-benzoylcarbamate (CID 2297773) is (2-methylphenyl) N-benzoylcarbamate.
What is the SMILES notation for (2-methylphenyl) N-benzoylcarbamate?
The canonical SMILES for (2-methylphenyl) N-benzoylcarbamate is Cc1ccccc1OC(=O)NC(=O)c1ccccc1.
What is the InChIKey of (2-methylphenyl) N-benzoylcarbamate?
The InChIKey is FNXPXYKWCLGYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c1-11-7-5-6-10-13(11)19-15(18)16-14(17)12-8-3-2-4-9-12/h2-10H,1H3,(H,16,17,18).
What are the key properties of (2-methylphenyl) N-benzoylcarbamate?
(2-methylphenyl) N-benzoylcarbamate has a molecular weight of 255.27 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylphenyl) N-benzoylcarbamate is sourced from PubChem (CID 2297773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).