2-phenacyloxybenzamide

C15H13NO3 — CID 43218588

IUPAC2-phenacyloxybenzamide
SMILESNC(=O)c1ccccc1OCC(=O)c1ccccc1
InChIInChI=1S/C15H13NO3/c16-15(18)12-8-4-5-9-14(12)19-10-13(17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,18)
InChIKeyBVSJEGUIZBFLJY-UHFFFAOYSA-N
MW255.27 g/mol
LogP2.05
Rot. Bonds5

About 2-phenacyloxybenzamide

2-phenacyloxybenzamide (PubChem CID 43218588) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is 2-phenacyloxybenzamide.

Molecular Properties

Compound Name2-phenacyloxybenzamide
PubChem CID43218588
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Name2-phenacyloxybenzamide
SMILESNC(=O)c1ccccc1OCC(=O)c1ccccc1
InChIInChI=1S/C15H13NO3/c16-15(18)12-8-4-5-9-14(12)19-10-13(17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,18)
InChIKeyBVSJEGUIZBFLJY-UHFFFAOYSA-N
XLogP2.05
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenacyloxybenzamide?
The IUPAC name of 2-phenacyloxybenzamide (CID 43218588) is 2-phenacyloxybenzamide.
What is the SMILES notation for 2-phenacyloxybenzamide?
The canonical SMILES for 2-phenacyloxybenzamide is NC(=O)c1ccccc1OCC(=O)c1ccccc1.
What is the InChIKey of 2-phenacyloxybenzamide?
The InChIKey is BVSJEGUIZBFLJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c16-15(18)12-8-4-5-9-14(12)19-10-13(17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,18).
What are the key properties of 2-phenacyloxybenzamide?
2-phenacyloxybenzamide has a molecular weight of 255.27 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenacyloxybenzamide is sourced from PubChem (CID 43218588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).