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

C19H15Br2NO3 — CID 3326030

IUPAC2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc3cc(Br)ccc3c2Br)cc1
InChIInChI=1S/C19H15Br2NO3/c1-24-15-6-4-14(5-7-15)22-18(23)11-25-17-9-2-12-10-13(20)3-8-16(12)19(17)21/h2-10H,11H2,1H3,(H,22,23)
InChIKeyRJCXRNMJORTUIS-UHFFFAOYSA-N
MW465.14 g/mol
LogP5.39
Rot. Bonds5

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

2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide (PubChem CID 3326030) has the molecular formula C19H15Br2NO3 and a molecular weight of 465.14 g/mol. Its IUPAC name is 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide
PubChem CID3326030
Molecular FormulaC19H15Br2NO3
Molecular Weight465.14 g/mol
Exact Mass462.94
IUPAC Name2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc3cc(Br)ccc3c2Br)cc1
InChIInChI=1S/C19H15Br2NO3/c1-24-15-6-4-14(5-7-15)22-18(23)11-25-17-9-2-12-10-13(20)3-8-16(12)19(17)21/h2-10H,11H2,1H3,(H,22,23)
InChIKeyRJCXRNMJORTUIS-UHFFFAOYSA-N
XLogP5.39
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.14
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxyphenyl) 2-(1,6-dibromonaphthalen-2-yl)oxyacetate
CID 3454697
N-[[[2-(1,6-dibromonaphthalen-2-yl)oxyacetyl]amino]carbamothioyl]-2-(4-methoxyphenoxy)acetamide
CID 3307662
2-(1,6-dibromonaphthalen-2-yl)oxy-N-[(2,5-dimethoxyphenyl)carbamothioyl]acetamide
CID 4636278
2-(1,6-dibromonaphthalen-2-yl)oxy-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 3330697
2-(1,6-dibromonaphthalen-2-yl)oxy-N-[(4-hydroxyphenyl)carbamothioyl]acetamide
CID 5120117
N-(2-bromophenyl)-2-(1,6-dibromonaphthalen-2-yl)oxyacetamide
CID 3250022
4-tert-butyl-N-[4-[[[2-(1,6-dibromonaphthalen-2-yl)oxyacetyl]amino]carbamoyl]phenyl]benzamide
CID 3380438
2-(1-bromonaphthalen-2-yl)oxy-N-(4-propan-2-yloxyphenyl)acetamide
CID 17340204
2-(1,6-dibromonaphthalen-2-yl)oxy-N-(2,4-dichlorophenyl)acetamide
CID 3380159
N-[(4-bromo-3-chlorophenyl)carbamothioyl]-2-(1,6-dibromonaphthalen-2-yl)oxyacetamide
CID 5208760
2-(1,6-dibromonaphthalen-2-yl)oxy-N-[[4-[[[2-(1,6-dibromonaphthalen-2-yl)oxyacetyl]hydrazinylidene]methyl]phenyl]methylideneamino]acetamide
CID 3358158
2-(1,6-dibromonaphthalen-2-yl)oxy-N-[(2-methoxynaphthalen-1-yl)methylideneamino]acetamide
CID 3351605

Frequently Asked Questions

What is the IUPAC name of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide (CID 3326030) is 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)COc2ccc3cc(Br)ccc3c2Br)cc1.
What is the InChIKey of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide?
The InChIKey is RJCXRNMJORTUIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Br2NO3/c1-24-15-6-4-14(5-7-15)22-18(23)11-25-17-9-2-12-10-13(20)3-8-16(12)19(17)21/h2-10H,11H2,1H3,(H,22,23).
What are the key properties of 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide?
2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide has a molecular weight of 465.14 g/mol, XLogP of 5.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,6-dibromonaphthalen-2-yl)oxy-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 3326030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).