2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide

C18H15BrN2O3 — CID 35577767

IUPAC2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc(Br)cc2)c2cccnc12
InChIInChI=1S/C18H15BrN2O3/c1-23-16-9-8-15(14-3-2-10-20-18(14)16)21-17(22)11-24-13-6-4-12(19)5-7-13/h2-10H,11H2,1H3,(H,21,22)
InChIKeyXBZQKRHZUHJJAW-UHFFFAOYSA-N
MW387.23 g/mol
LogP4.02
Rot. Bonds5

About 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide

2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide (PubChem CID 35577767) has the molecular formula C18H15BrN2O3 and a molecular weight of 387.23 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide
PubChem CID35577767
Molecular FormulaC18H15BrN2O3
Molecular Weight387.23 g/mol
Exact Mass386.03
IUPAC Name2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc(Br)cc2)c2cccnc12
InChIInChI=1S/C18H15BrN2O3/c1-23-16-9-8-15(14-3-2-10-20-18(14)16)21-17(22)11-24-13-6-4-12(19)5-7-13/h2-10H,11H2,1H3,(H,21,22)
InChIKeyXBZQKRHZUHJJAW-UHFFFAOYSA-N
XLogP4.02
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.23
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenoxy)-N-(8-methoxyquinolin-5-yl)acetamide
CID 26823047
2-(4-chlorophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide
CID 26823034
N-(8-methoxyquinolin-5-yl)-3-methylbutanamide
CID 26823099
4-methoxy-N-(8-methoxyquinolin-5-yl)butanamide
CID 47383104
N-(8-butoxyquinolin-5-yl)-2-(4-propan-2-ylphenoxy)acetamide
CID 26823452
N-(8-methoxyquinolin-5-yl)-2-propan-2-ylsulfonylacetamide
CID 86835306
2-(3,4-dichlorophenyl)-N-(8-methoxyquinolin-5-yl)acetamide
CID 60575303
2-ethyl-N-(8-methoxyquinolin-5-yl)butanamide
CID 26823136
N-(5-bromo-2-methoxyphenyl)-2-phenoxyacetamide
CID 47317656
2-(3,5-dimethylphenoxy)-N-(8-methylquinolin-5-yl)acetamide
CID 38277487
2-(4-bromophenoxy)-N-(3,4-dimethoxyphenyl)acetamide
CID 2303718
2-(5,7-dibromoquinolin-8-yl)oxy-N-(2-methoxyphenyl)acetamide
CID 91455867

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide (CID 35577767) is 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide is COc1ccc(NC(=O)COc2ccc(Br)cc2)c2cccnc12.
What is the InChIKey of 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide?
The InChIKey is XBZQKRHZUHJJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2O3/c1-23-16-9-8-15(14-3-2-10-20-18(14)16)21-17(22)11-24-13-6-4-12(19)5-7-13/h2-10H,11H2,1H3,(H,21,22).
What are the key properties of 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide?
2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide has a molecular weight of 387.23 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide is sourced from PubChem (CID 35577767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).