2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide

C16H16BrNO2 — CID 7935227

IUPAC2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)COc2cccc(Br)c2)c1
InChIInChI=1S/C16H16BrNO2/c1-2-12-5-3-7-14(9-12)18-16(19)11-20-15-8-4-6-13(17)10-15/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyJYLQJMWGUWANHA-UHFFFAOYSA-N
MW334.21 g/mol
LogP4.03
Rot. Bonds5

About 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide

2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide (PubChem CID 7935227) has the molecular formula C16H16BrNO2 and a molecular weight of 334.21 g/mol. Its IUPAC name is 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
PubChem CID7935227
Molecular FormulaC16H16BrNO2
Molecular Weight334.21 g/mol
Exact Mass333.04
IUPAC Name2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)COc2cccc(Br)c2)c1
InChIInChI=1S/C16H16BrNO2/c1-2-12-5-3-7-14(9-12)18-16(19)11-20-15-8-4-6-13(17)10-15/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyJYLQJMWGUWANHA-UHFFFAOYSA-N
XLogP4.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.21
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethylphenoxy)-N-(3-fluorophenyl)acetamide
CID 2709979
3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide
CID 31524865
3-[[2-(3-bromophenoxy)acetyl]amino]-N,N-diethylbenzamide
CID 27875323
N-(3-ethylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 34280640
N-(3-ethylphenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61028344
2-(4-acetamidophenoxy)-N-(3-ethylphenyl)acetamide
CID 7203355
N-(3-bromophenyl)-2-(3-hydroxyphenoxy)acetamide
CID 43143567
2-(2-bromo-4-ethylphenoxy)-N-(3-bromophenyl)acetamide
CID 19202087
dimethyl 5-[[2-(3-ethylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2711605
2-(3-bromophenoxy)-N-(4-butylphenyl)acetamide
CID 19171423
2-(3-ethylphenoxy)-N-(3-heptoxyphenyl)acetamide
CID 43912190
N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide
CID 7917215

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide?
The IUPAC name of 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide (CID 7935227) is 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide.
What is the SMILES notation for 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide?
The canonical SMILES for 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide is CCc1cccc(NC(=O)COc2cccc(Br)c2)c1.
What is the InChIKey of 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide?
The InChIKey is JYLQJMWGUWANHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrNO2/c1-2-12-5-3-7-14(9-12)18-16(19)11-20-15-8-4-6-13(17)10-15/h3-10H,2,11H2,1H3,(H,18,19).
What are the key properties of 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide?
2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide has a molecular weight of 334.21 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide is sourced from PubChem (CID 7935227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).