N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide

C17H11Cl2FN2O2 — CID 8716349

IUPACN-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
SMILESO=C(COc1ccc(Cl)c2cccnc12)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C17H11Cl2FN2O2/c18-12-4-6-15(17-11(12)2-1-7-21-17)24-9-16(23)22-10-3-5-14(20)13(19)8-10/h1-8H,9H2,(H,22,23)
InChIKeyCQQZSDSDGWWMQF-UHFFFAOYSA-N
MW365.19 g/mol
LogP4.70
Rot. Bonds4

About N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide

N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide (PubChem CID 8716349) has the molecular formula C17H11Cl2FN2O2 and a molecular weight of 365.19 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
PubChem CID8716349
Molecular FormulaC17H11Cl2FN2O2
Molecular Weight365.19 g/mol
Exact Mass364.02
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
SMILESO=C(COc1ccc(Cl)c2cccnc12)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C17H11Cl2FN2O2/c18-12-4-6-15(17-11(12)2-1-7-21-17)24-9-16(23)22-10-3-5-14(20)13(19)8-10/h1-8H,9H2,(H,22,23)
InChIKeyCQQZSDSDGWWMQF-UHFFFAOYSA-N
XLogP4.70
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.19
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide (CID 8716349) is N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide is O=C(COc1ccc(Cl)c2cccnc12)Nc1ccc(F)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide?
The InChIKey is CQQZSDSDGWWMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl2FN2O2/c18-12-4-6-15(17-11(12)2-1-7-21-17)24-9-16(23)22-10-3-5-14(20)13(19)8-10/h1-8H,9H2,(H,22,23).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide?
N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide has a molecular weight of 365.19 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide is sourced from PubChem (CID 8716349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).