2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide

C20H18BrNO2 — CID 7786804

IUPAC2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide
SMILESCc1cc(C)cc(NC(=O)COc2ccc3cc(Br)ccc3c2)c1
InChIInChI=1S/C20H18BrNO2/c1-13-7-14(2)9-18(8-13)22-20(23)12-24-19-6-4-15-10-17(21)5-3-16(15)11-19/h3-11H,12H2,1-2H3,(H,22,23)
InChIKeyINHQGUVGBAZJDM-UHFFFAOYSA-N
MW384.27 g/mol
LogP5.24
Rot. Bonds4

About 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide

2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide (PubChem CID 7786804) has the molecular formula C20H18BrNO2 and a molecular weight of 384.27 g/mol. Its IUPAC name is 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide
PubChem CID7786804
Molecular FormulaC20H18BrNO2
Molecular Weight384.27 g/mol
Exact Mass383.05
IUPAC Name2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide
SMILESCc1cc(C)cc(NC(=O)COc2ccc3cc(Br)ccc3c2)c1
InChIInChI=1S/C20H18BrNO2/c1-13-7-14(2)9-18(8-13)22-20(23)12-24-19-6-4-15-10-17(21)5-3-16(15)11-19/h3-11H,12H2,1-2H3,(H,22,23)
InChIKeyINHQGUVGBAZJDM-UHFFFAOYSA-N
XLogP5.24
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.27
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide
CID 7652726
2-(6-bromonaphthalen-2-yl)oxy-N-naphthalen-2-ylacetamide
CID 7786811
2-(6-bromonaphthalen-2-yl)oxy-N-[4-(diethylamino)phenyl]acetamide
CID 3872632
2-(6-bromonaphthalen-2-yl)oxy-N-(2-hydroxy-5-methylphenyl)acetamide
CID 60562066
2-(4-bromo-2-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 695854
3-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N,N-dimethylbenzamide
CID 29464616
2-(4-bromo-2-ethylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 19201533
N-(1,3-benzodioxol-5-yl)-2-(6-bromonaphthalen-2-yl)oxyacetamide
CID 7786798
2-bromo-6-[(3,5-dimethylphenyl)methoxy]naphthalene
CID 60624731
N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide
CID 54793228
2-(6-bromonaphthalen-2-yl)oxy-N-(2-methylpropyl)acetamide
CID 3989542
2-(4-bromo-2-propan-2-ylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 17188857

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide?
The IUPAC name of 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide (CID 7786804) is 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide?
The canonical SMILES for 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide is Cc1cc(C)cc(NC(=O)COc2ccc3cc(Br)ccc3c2)c1.
What is the InChIKey of 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide?
The InChIKey is INHQGUVGBAZJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18BrNO2/c1-13-7-14(2)9-18(8-13)22-20(23)12-24-19-6-4-15-10-17(21)5-3-16(15)11-19/h3-11H,12H2,1-2H3,(H,22,23).
What are the key properties of 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide?
2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide has a molecular weight of 384.27 g/mol, XLogP of 5.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide is sourced from PubChem (CID 7786804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).