2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide

C10H11BrClNO2 — CID 965234

IUPAC2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide
SMILESCCNC(=O)COc1ccc(Br)cc1Cl
InChIInChI=1S/C10H11BrClNO2/c1-2-13-10(14)6-15-9-4-3-7(11)5-8(9)12/h3-5H,2,6H2,1H3,(H,13,14)
InChIKeyQZLZGGQDFUFKPC-UHFFFAOYSA-N
MW292.56 g/mol
LogP2.62
Rot. Bonds4

About 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide

2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide (PubChem CID 965234) has the molecular formula C10H11BrClNO2 and a molecular weight of 292.56 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide
PubChem CID965234
Molecular FormulaC10H11BrClNO2
Molecular Weight292.56 g/mol
Exact Mass290.97
IUPAC Name2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide
SMILESCCNC(=O)COc1ccc(Br)cc1Cl
InChIInChI=1S/C10H11BrClNO2/c1-2-13-10(14)6-15-9-4-3-7(11)5-8(9)12/h3-5H,2,6H2,1H3,(H,13,14)
InChIKeyQZLZGGQDFUFKPC-UHFFFAOYSA-N
XLogP2.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.56
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-chlorophenoxy)-N-cyclohexyl-N-methylacetamide
CID 1226778
2-(2,4-dichlorophenoxy)-N-(propan-2-yl)acetamide
CID 684074
2-(4-bromo-2-chlorophenoxy)-N,N-diethylacetamide
CID 885680
2-(4-Bromo-2-chlorophenoxy)-1-(pyrrolidin-1-yl)ethanone
CID 885808
2-(4-bromo-2-chlorophenoxy)-N-cyclohexylacetamide
CID 885937
2-(4-bromo-2-chlorophenoxy)-N,N-di(propan-2-yl)acetamide
CID 2230655
2-(4-bromo-2-chlorophenoxy)-N-prop-2-enylacetamide
CID 2234817
2-(4-bromo-2-chlorophenoxy)-N-(3-methoxypropyl)acetamide
CID 2906779
[3-(4-Bromo-2-chlorophenoxy)propyl](2-methoxyethyl)amine oxalate
CID 2922897
2-(4-bromo-2-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 3882773
2-(2,4-dichlorophenoxy)-N-(2-methoxyethyl)propanamide
CID 4995082
2-(2-chlorophenoxy)-N-cyclopropylacetamide
CID 977691

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide?
The IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide (CID 965234) is 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide.
What is the SMILES notation for 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide?
The canonical SMILES for 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide is CCNC(=O)COc1ccc(Br)cc1Cl.
What is the InChIKey of 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide?
The InChIKey is QZLZGGQDFUFKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClNO2/c1-2-13-10(14)6-15-9-4-3-7(11)5-8(9)12/h3-5H,2,6H2,1H3,(H,13,14).
What are the key properties of 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide?
2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide has a molecular weight of 292.56 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenoxy)-N-ethylacetamide is sourced from PubChem (CID 965234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).