2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide

C18H13BrClNO2 — CID 1010815

IUPAC2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide
SMILESO=C(COc1ccc2ccccc2c1Br)Nc1ccc(Cl)cc1
InChIInChI=1S/C18H13BrClNO2/c19-18-15-4-2-1-3-12(15)5-10-16(18)23-11-17(22)21-14-8-6-13(20)7-9-14/h1-10H,11H2,(H,21,22)
InChIKeyLOKVHCCLVBXCCC-UHFFFAOYSA-N
MW390.66 g/mol
LogP5.27
Rot. Bonds4

About 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide

2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide (PubChem CID 1010815) has the molecular formula C18H13BrClNO2 and a molecular weight of 390.66 g/mol. Its IUPAC name is 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide
PubChem CID1010815
Molecular FormulaC18H13BrClNO2
Molecular Weight390.66 g/mol
Exact Mass388.98
IUPAC Name2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide
SMILESO=C(COc1ccc2ccccc2c1Br)Nc1ccc(Cl)cc1
InChIInChI=1S/C18H13BrClNO2/c19-18-15-4-2-1-3-12(15)5-10-16(18)23-11-17(22)21-14-8-6-13(20)7-9-14/h1-10H,11H2,(H,21,22)
InChIKeyLOKVHCCLVBXCCC-UHFFFAOYSA-N
XLogP5.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.66
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]-N-methylbenzamide
CID 24605889
2-(1-bromonaphthalen-2-yl)oxy-N-(4-sulfamoylphenyl)acetamide
CID 1186575
2-(1-bromonaphthalen-2-yl)oxy-N-(2-chlorophenyl)acetamide
CID 1010729
2-(1-bromonaphthalen-2-yl)oxy-N-(4-propan-2-yloxyphenyl)acetamide
CID 17340204
2-(1-bromonaphthalen-2-yl)oxy-N-(4-ethylsulfonylphenyl)acetamide
CID 37027688
4-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]-N-propylbenzamide
CID 17218734
3-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]benzamide
CID 26160442
N-(2-acetamidophenyl)-2-(1-bromonaphthalen-2-yl)oxyacetamide
CID 1300372
2-(1-bromonaphthalen-2-yl)oxy-N-(1H-indazol-5-yl)acetamide
CID 55599649
N-[[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]carbamothioyl]-4-chlorobenzamide
CID 3547891
2-(1-bromonaphthalen-2-yl)oxy-N-(6-chloro-1,3-benzothiazol-2-yl)acetamide
CID 54783479
N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-2,4-dichlorobenzohydrazide
CID 3367158

Frequently Asked Questions

What is the IUPAC name of 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide (CID 1010815) is 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide is O=C(COc1ccc2ccccc2c1Br)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide?
The InChIKey is LOKVHCCLVBXCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13BrClNO2/c19-18-15-4-2-1-3-12(15)5-10-16(18)23-11-17(22)21-14-8-6-13(20)7-9-14/h1-10H,11H2,(H,21,22).
What are the key properties of 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide?
2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide has a molecular weight of 390.66 g/mol, XLogP of 5.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-bromonaphthalen-2-yl)oxy-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 1010815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).