2-(2-bromophenyl)-N-(2-phenylethyl)acetamide

C16H16BrNO — CID 86025438

IUPAC2-(2-bromophenyl)-N-(2-phenylethyl)acetamide
SMILESO=C(Cc1ccccc1Br)NCCc1ccccc1
InChIInChI=1S/C16H16BrNO/c17-15-9-5-4-8-14(15)12-16(19)18-11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,18,19)
InChIKeyGWTIBXDECLGFJU-UHFFFAOYSA-N
MW318.21 g/mol
LogP3.35
Rot. Bonds5

About 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide

2-(2-bromophenyl)-N-(2-phenylethyl)acetamide (PubChem CID 86025438) has the molecular formula C16H16BrNO and a molecular weight of 318.21 g/mol. Its IUPAC name is 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2-bromophenyl)-N-(2-phenylethyl)acetamide
PubChem CID86025438
Molecular FormulaC16H16BrNO
Molecular Weight318.21 g/mol
Exact Mass317.04
IUPAC Name2-(2-bromophenyl)-N-(2-phenylethyl)acetamide
SMILESO=C(Cc1ccccc1Br)NCCc1ccccc1
InChIInChI=1S/C16H16BrNO/c17-15-9-5-4-8-14(15)12-16(19)18-11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,18,19)
InChIKeyGWTIBXDECLGFJU-UHFFFAOYSA-N
XLogP3.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.21
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[[2-(2-bromophenyl)acetyl]amino]propanoic acid
CID 115729925
2-(4-bromophenyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
CID 112993255
N-[2-(4-hydroxyphenyl)ethyl]-2-phenylacetamide
CID 11857553
2-(2-bromophenyl)-N-pentylacetamide
CID 113098374
2-(2-bromophenyl)sulfanyl-N-(2-phenylethyl)acetamide
CID 92513723
2-naphthalen-2-yl-N-(2-phenylethyl)acetamide
CID 26913082
N'-[2-(2-fluorophenyl)ethyl]-N-(2-phenylethyl)propanediamide
CID 108947912
2-(2-bromophenyl)-N-[2-(cyclopropylamino)ethyl]acetamide;hydrochloride
CID 86813788
2-(2,4-dimethylphenyl)-N-(2-phenylethyl)acetamide
CID 100770824
2-bromo-N-[2-(3-phenylpropanoylamino)ethyl]benzamide
CID 108539128
(2S)-2-amino-N-[(2-bromophenyl)methyl]-4-phenylbutanamide
CID 104984212
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-2-(2-bromophenyl)acetamide
CID 112992422

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide (CID 86025438) is 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide is O=C(Cc1ccccc1Br)NCCc1ccccc1.
What is the InChIKey of 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide?
The InChIKey is GWTIBXDECLGFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrNO/c17-15-9-5-4-8-14(15)12-16(19)18-11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,18,19).
What are the key properties of 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide?
2-(2-bromophenyl)-N-(2-phenylethyl)acetamide has a molecular weight of 318.21 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 86025438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).