2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide

C17H10ClF3N2O2 — CID 8716409

IUPAC2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide
SMILESO=C(COc1ccc(Cl)c2cccnc12)Nc1ccc(F)c(F)c1F
InChIInChI=1S/C17H10ClF3N2O2/c18-10-3-6-13(17-9(10)2-1-7-22-17)25-8-14(24)23-12-5-4-11(19)15(20)16(12)21/h1-7H,8H2,(H,23,24)
InChIKeyQOHXSVPHAVMDTC-UHFFFAOYSA-N
MW366.73 g/mol
LogP4.32
Rot. Bonds4

About 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide

2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide (PubChem CID 8716409) has the molecular formula C17H10ClF3N2O2 and a molecular weight of 366.73 g/mol. Its IUPAC name is 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide
PubChem CID8716409
Molecular FormulaC17H10ClF3N2O2
Molecular Weight366.73 g/mol
Exact Mass366.04
IUPAC Name2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide
SMILESO=C(COc1ccc(Cl)c2cccnc12)Nc1ccc(F)c(F)c1F
InChIInChI=1S/C17H10ClF3N2O2/c18-10-3-6-13(17-9(10)2-1-7-22-17)25-8-14(24)23-12-5-4-11(19)15(20)16(12)21/h1-7H,8H2,(H,23,24)
InChIKeyQOHXSVPHAVMDTC-UHFFFAOYSA-N
XLogP4.32
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.73
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

N-(5-chloro-2-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716254
N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716349
N-(2-acetylphenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716322
2-(5-chloroquinolin-8-yl)oxy-N-(2,6-dimethylphenyl)acetamide
CID 8716363
methyl 2-(5-chloroquinolin-8-yl)oxyacetate
CID 15257198
2-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]-N-(4-fluorophenyl)acetamide
CID 8716441
2-(5-chloroquinolin-8-yl)oxy-N-(3,5-dimethoxyphenyl)acetamide
CID 8005978
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716466
2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide
CID 55828463
N-(2-chloro-4,6-dimethylphenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716287
2-(5-chloroquinolin-8-yl)oxy-N-(2-methyl-5-nitrophenyl)acetamide
CID 8716261
N'-[2-(5-chloroquinolin-8-yl)oxyacetyl]benzohydrazide
CID 55602763

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide?
The IUPAC name of 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide (CID 8716409) is 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide.
What is the SMILES notation for 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide?
The canonical SMILES for 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide is O=C(COc1ccc(Cl)c2cccnc12)Nc1ccc(F)c(F)c1F.
What is the InChIKey of 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide?
The InChIKey is QOHXSVPHAVMDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10ClF3N2O2/c18-10-3-6-13(17-9(10)2-1-7-22-17)25-8-14(24)23-12-5-4-11(19)15(20)16(12)21/h1-7H,8H2,(H,23,24).
What are the key properties of 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide?
2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide has a molecular weight of 366.73 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide is sourced from PubChem (CID 8716409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).