2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide

C18H12Cl2F2N2O2 — CID 2357496

IUPAC2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide
SMILESCc1ccc2c(Cl)cc(Cl)c(OCC(=O)Nc3c(F)cccc3F)c2n1
InChIInChI=1S/C18H12Cl2F2N2O2/c1-9-5-6-10-11(19)7-12(20)18(16(10)23-9)26-8-15(25)24-17-13(21)3-2-4-14(17)22/h2-7H,8H2,1H3,(H,24,25)
InChIKeyOUCYYRQDYNYXMY-UHFFFAOYSA-N
MW397.21 g/mol
LogP5.15
Rot. Bonds4

About 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide

2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide (PubChem CID 2357496) has the molecular formula C18H12Cl2F2N2O2 and a molecular weight of 397.21 g/mol. Its IUPAC name is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide
PubChem CID2357496
Molecular FormulaC18H12Cl2F2N2O2
Molecular Weight397.21 g/mol
Exact Mass396.02
IUPAC Name2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide
SMILESCc1ccc2c(Cl)cc(Cl)c(OCC(=O)Nc3c(F)cccc3F)c2n1
InChIInChI=1S/C18H12Cl2F2N2O2/c1-9-5-6-10-11(19)7-12(20)18(16(10)23-9)26-8-15(25)24-17-13(21)3-2-4-14(17)22/h2-7H,8H2,1H3,(H,24,25)
InChIKeyOUCYYRQDYNYXMY-UHFFFAOYSA-N
XLogP5.15
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.21
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide?
The IUPAC name of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide (CID 2357496) is 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide.
What is the SMILES notation for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide?
The canonical SMILES for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide is Cc1ccc2c(Cl)cc(Cl)c(OCC(=O)Nc3c(F)cccc3F)c2n1.
What is the InChIKey of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide?
The InChIKey is OUCYYRQDYNYXMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2F2N2O2/c1-9-5-6-10-11(19)7-12(20)18(16(10)23-9)26-8-15(25)24-17-13(21)3-2-4-14(17)22/h2-7H,8H2,1H3,(H,24,25).
What are the key properties of 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide?
2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide has a molecular weight of 397.21 g/mol, XLogP of 5.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-dichloro-2-methylquinolin-8-yl)oxy-N-(2,6-difluorophenyl)acetamide is sourced from PubChem (CID 2357496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).