2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide

C15H14BrClN2O3 — CID 34877130

IUPAC2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide
SMILESCCOc1ncccc1NC(=O)COc1ccc(Cl)cc1Br
InChIInChI=1S/C15H14BrClN2O3/c1-2-21-15-12(4-3-7-18-15)19-14(20)9-22-13-6-5-10(17)8-11(13)16/h3-8H,2,9H2,1H3,(H,19,20)
InChIKeyAFGAUTLAOSIYDM-UHFFFAOYSA-N
MW385.65 g/mol
LogP3.91
Rot. Bonds6

About 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide

2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide (PubChem CID 34877130) has the molecular formula C15H14BrClN2O3 and a molecular weight of 385.65 g/mol. Its IUPAC name is 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide
PubChem CID34877130
Molecular FormulaC15H14BrClN2O3
Molecular Weight385.65 g/mol
Exact Mass383.99
IUPAC Name2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide
SMILESCCOc1ncccc1NC(=O)COc1ccc(Cl)cc1Br
InChIInChI=1S/C15H14BrClN2O3/c1-2-21-15-12(4-3-7-18-15)19-14(20)9-22-13-6-5-10(17)8-11(13)16/h3-8H,2,9H2,1H3,(H,19,20)
InChIKeyAFGAUTLAOSIYDM-UHFFFAOYSA-N
XLogP3.91
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.65
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxyphenyl)acetamide
CID 1367163
2-(2-bromo-4-chlorophenoxy)-N-(2-fluorophenyl)acetamide
CID 2627508
methyl 2-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]benzoate
CID 1213645
2-(2-bromo-4-chlorophenoxy)-N-[2-(hydroxymethyl)phenyl]acetamide
CID 1213643
2-(2-bromo-4-chlorophenoxy)-N-[4-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]-1,2,5-oxadiazol-3-yl]acetamide
CID 3306540
N-(4-amino-2-chlorophenyl)-2-(2-bromo-4-chlorophenoxy)acetamide
CID 28510783
5-bromo-2-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
CID 34958257
2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide
CID 30795617
3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
CID 34958850
2-(2,4-dichlorophenoxy)-N-quinolin-8-ylacetamide
CID 2180532
2-[[2-(2-bromo-4-chlorophenoxy)acetyl]-methylamino]-N-(2-chlorophenyl)acetamide
CID 34597943
2-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 17150278

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide (CID 34877130) is 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide is CCOc1ncccc1NC(=O)COc1ccc(Cl)cc1Br.
What is the InChIKey of 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide?
The InChIKey is AFGAUTLAOSIYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O3/c1-2-21-15-12(4-3-7-18-15)19-14(20)9-22-13-6-5-10(17)8-11(13)16/h3-8H,2,9H2,1H3,(H,19,20).
What are the key properties of 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide?
2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide has a molecular weight of 385.65 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 34877130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).