N-benzyl-2-(2-bromophenoxy)acetamide

C15H14BrNO2 — CID 2072955

IUPACN-benzyl-2-(2-bromophenoxy)acetamide
SMILESO=C(COc1ccccc1Br)NCc1ccccc1
InChIInChI=1S/C15H14BrNO2/c16-13-8-4-5-9-14(13)19-11-15(18)17-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)
InChIKeyQOYFJQRNVUTUQU-UHFFFAOYSA-N
MW320.19 g/mol
LogP3.14
Rot. Bonds5

About N-benzyl-2-(2-bromophenoxy)acetamide

N-benzyl-2-(2-bromophenoxy)acetamide (PubChem CID 2072955) has the molecular formula C15H14BrNO2 and a molecular weight of 320.19 g/mol. Its IUPAC name is N-benzyl-2-(2-bromophenoxy)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(2-bromophenoxy)acetamide
PubChem CID2072955
Molecular FormulaC15H14BrNO2
Molecular Weight320.19 g/mol
Exact Mass319.02
IUPAC NameN-benzyl-2-(2-bromophenoxy)acetamide
SMILESO=C(COc1ccccc1Br)NCc1ccccc1
InChIInChI=1S/C15H14BrNO2/c16-13-8-4-5-9-14(13)19-11-15(18)17-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)
InChIKeyQOYFJQRNVUTUQU-UHFFFAOYSA-N
XLogP3.14
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2-bromophenoxy)acetamide?
The IUPAC name of N-benzyl-2-(2-bromophenoxy)acetamide (CID 2072955) is N-benzyl-2-(2-bromophenoxy)acetamide.
What is the SMILES notation for N-benzyl-2-(2-bromophenoxy)acetamide?
The canonical SMILES for N-benzyl-2-(2-bromophenoxy)acetamide is O=C(COc1ccccc1Br)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(2-bromophenoxy)acetamide?
The InChIKey is QOYFJQRNVUTUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO2/c16-13-8-4-5-9-14(13)19-11-15(18)17-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18).
What are the key properties of N-benzyl-2-(2-bromophenoxy)acetamide?
N-benzyl-2-(2-bromophenoxy)acetamide has a molecular weight of 320.19 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-bromophenoxy)acetamide is sourced from PubChem (CID 2072955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).