2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide

C18H20BrNO3 — CID 17074248

IUPAC2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1ccccc1NC(=O)COc1ccc(Br)cc1
InChIInChI=1S/C18H20BrNO3/c1-13(2)11-23-17-6-4-3-5-16(17)20-18(21)12-22-15-9-7-14(19)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,20,21)
InChIKeyGGWQFMYHKCSPEY-UHFFFAOYSA-N
MW378.27 g/mol
LogP4.50
Rot. Bonds7

About 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide

2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide (PubChem CID 17074248) has the molecular formula C18H20BrNO3 and a molecular weight of 378.27 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
PubChem CID17074248
Molecular FormulaC18H20BrNO3
Molecular Weight378.27 g/mol
Exact Mass377.06
IUPAC Name2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1ccccc1NC(=O)COc1ccc(Br)cc1
InChIInChI=1S/C18H20BrNO3/c1-13(2)11-23-17-6-4-3-5-16(17)20-18(21)12-22-15-9-7-14(19)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,20,21)
InChIKeyGGWQFMYHKCSPEY-UHFFFAOYSA-N
XLogP4.50
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.27
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2-ethoxyanilino)-2-oxoethyl] 2-(4-bromophenoxy)acetate
CID 9140411
N,N'-bis[2-(2-methylpropoxy)phenyl]hexanediamide
CID 17074524
N,N'-bis[2-(2-methylpropoxy)phenyl]nonanediamide
CID 17074526
2-(2-aminoethoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 79474018
N-(2-ethoxyphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 723516
5-bromo-N-[2-(2-methylpropoxy)phenyl]pyridine-2-carboxamide
CID 62952857
2-(4-bromophenoxy)-N-[(2-ethoxyphenyl)carbamothioyl]acetamide
CID 21212223
4-[2-(4-bromoanilino)-2-oxoethoxy]-N-(2-ethoxyphenyl)benzamide
CID 156704858
2-(4-chloro-2-methylphenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 17074239
4-hydroxy-N-[2-(2-methylpropoxy)phenyl]butanamide
CID 79203312
N-(2-ethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 727173
2-[[2-(4-bromophenoxy)acetyl]amino]-N,N-dimethylbenzamide
CID 4942499

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide (CID 17074248) is 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide is CC(C)COc1ccccc1NC(=O)COc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The InChIKey is GGWQFMYHKCSPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20BrNO3/c1-13(2)11-23-17-6-4-3-5-16(17)20-18(21)12-22-15-9-7-14(19)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,20,21).
What are the key properties of 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide?
2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide has a molecular weight of 378.27 g/mol, XLogP of 4.50, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide is sourced from PubChem (CID 17074248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).