2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide

C19H17BrN2O3 — CID 100828868

IUPAC2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)COc1cc(C)nc2ccc(Br)cc12
InChIInChI=1S/C19H17BrN2O3/c1-12-9-18(14-10-13(20)7-8-15(14)21-12)25-11-19(23)22-16-5-3-4-6-17(16)24-2/h3-10H,11H2,1-2H3,(H,22,23)
InChIKeyWJDDNMWOQLDCMX-UHFFFAOYSA-N
MW401.26 g/mol
LogP4.33
Rot. Bonds5

About 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide

2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide (PubChem CID 100828868) has the molecular formula C19H17BrN2O3 and a molecular weight of 401.26 g/mol. Its IUPAC name is 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
PubChem CID100828868
Molecular FormulaC19H17BrN2O3
Molecular Weight401.26 g/mol
Exact Mass400.04
IUPAC Name2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)COc1cc(C)nc2ccc(Br)cc12
InChIInChI=1S/C19H17BrN2O3/c1-12-9-18(14-10-13(20)7-8-15(14)21-12)25-11-19(23)22-16-5-3-4-6-17(16)24-2/h3-10H,11H2,1-2H3,(H,22,23)
InChIKeyWJDDNMWOQLDCMX-UHFFFAOYSA-N
XLogP4.33
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.26
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(6-methoxy-2-methyl-4-quinolyl)oxy]-N-(2-methoxyphenyl)acetamide
CID 70685044
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(4-pentylphenyl)acetamide
CID 137653074
N-benzyl-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 70682976
N-Benzyl-2-(6-bromo-2-methyl-quinolin-4-yloxy)-acetamide
CID 70691354
N-(4-bromophenyl)-6-ethoxy-2-methylquinolin-4-amine
CID 1187199
N-(3,5-dimethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 2405852
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(4-methylphenyl)acetamide
CID 112787470
N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 112787483
N-(4-butylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 137632576
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(4-propylphenyl)acetamide
CID 137643591
N-(3,4-dimethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 137652660
2-(2-ethyl-6-methoxyquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide
CID 137653028

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide (CID 100828868) is 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)COc1cc(C)nc2ccc(Br)cc12.
What is the InChIKey of 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
The InChIKey is WJDDNMWOQLDCMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17BrN2O3/c1-12-9-18(14-10-13(20)7-8-15(14)21-12)25-11-19(23)22-16-5-3-4-6-17(16)24-2/h3-10H,11H2,1-2H3,(H,22,23).
What are the key properties of 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide?
2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide has a molecular weight of 401.26 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-2-methylquinolin-4-yl)oxy-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 100828868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).