2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide

C18H11Br2Cl2NO2 — CID 3380159

IUPAC2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide
SMILESO=C(COc1ccc2cc(Br)ccc2c1Br)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H11Br2Cl2NO2/c19-11-2-4-13-10(7-11)1-6-16(18(13)20)25-9-17(24)23-15-5-3-12(21)8-14(15)22/h1-8H,9H2,(H,23,24)
InChIKeyZLFTVCUOIRNCTB-UHFFFAOYSA-N
MW504.01 g/mol
LogP6.69
Rot. Bonds4

About 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide

2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide (PubChem CID 3380159) has the molecular formula C18H11Br2Cl2NO2 and a molecular weight of 504.01 g/mol. Its IUPAC name is 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide
PubChem CID3380159
Molecular FormulaC18H11Br2Cl2NO2
Molecular Weight504.01 g/mol
Exact Mass500.85
IUPAC Name2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide
SMILESO=C(COc1ccc2cc(Br)ccc2c1Br)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H11Br2Cl2NO2/c19-11-2-4-13-10(7-11)1-6-16(18(13)20)25-9-17(24)23-15-5-3-12(21)8-14(15)22/h1-8H,9H2,(H,23,24)
InChIKeyZLFTVCUOIRNCTB-UHFFFAOYSA-N
XLogP6.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500504.01
LogP ≤ 56.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromophenyl)-2-(1,6-dibromonaphthalen-2-yl)oxyacetamide
CID 3250022
2-(1-bromonaphthalen-2-yl)oxy-N-(2-chloro-4-fluorophenyl)acetamide
CID 7642313
2-(1-bromonaphthalen-2-yl)oxy-N-(2-chlorophenyl)acetamide
CID 1010729
2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide
CID 30795617
2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide
CID 3326030
2-(4-chloro-2-methylphenoxy)-N-(2,4-dichlorophenyl)acetamide
CID 923084
N-(4-chloro-2-methylphenyl)-2-(2,4-dibromophenoxy)acetamide
CID 1189036
2-(6-bromo-2-methoxynaphthalen-1-yl)-N'-[2-(2,4-dichlorophenoxy)acetyl]acetohydrazide
CID 4729784
N-(4-amino-2-chlorophenyl)-2-(2-bromo-4-chlorophenoxy)acetamide
CID 28510783
N-(4-amino-2-chlorophenyl)-2-(4-bromo-2-fluorophenoxy)acetamide
CID 28971332
4-[2-[[2-(2,4-dibromophenoxy)acetyl]carbamothioyl]hydrazinyl]-N-(2,4-dichlorophenyl)-4-oxobutanamide
CID 4505747
N-[(4-bromo-3-chlorophenyl)carbamothioyl]-2-(1,6-dibromonaphthalen-2-yl)oxyacetamide
CID 5208760

Frequently Asked Questions

What is the IUPAC name of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide?
The IUPAC name of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide (CID 3380159) is 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide?
The canonical SMILES for 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide is O=C(COc1ccc2cc(Br)ccc2c1Br)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide?
The InChIKey is ZLFTVCUOIRNCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11Br2Cl2NO2/c19-11-2-4-13-10(7-11)1-6-16(18(13)20)25-9-17(24)23-15-5-3-12(21)8-14(15)22/h1-8H,9H2,(H,23,24).
What are the key properties of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide?
2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide has a molecular weight of 504.01 g/mol, XLogP of 6.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide is sourced from PubChem (CID 3380159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).