2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide

C17H14F4N2O — CID 37197085

IUPAC2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide
SMILESO=C(CN1CCCc2c(F)cc(F)cc21)Nc1cc(F)ccc1F
InChIInChI=1S/C17H14F4N2O/c18-10-3-4-13(20)15(7-10)22-17(24)9-23-5-1-2-12-14(21)6-11(19)8-16(12)23/h3-4,6-8H,1-2,5,9H2,(H,22,24)
InChIKeyLQACVGSVBBHRSL-UHFFFAOYSA-N
MW338.30 g/mol
LogP3.63
Rot. Bonds3

About 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide

2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide (PubChem CID 37197085) has the molecular formula C17H14F4N2O and a molecular weight of 338.30 g/mol. Its IUPAC name is 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide
PubChem CID37197085
Molecular FormulaC17H14F4N2O
Molecular Weight338.30 g/mol
Exact Mass338.10
IUPAC Name2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide
SMILESO=C(CN1CCCc2c(F)cc(F)cc21)Nc1cc(F)ccc1F
InChIInChI=1S/C17H14F4N2O/c18-10-3-4-13(20)15(7-10)22-17(24)9-23-5-1-2-12-14(21)6-11(19)8-16(12)23/h3-4,6-8H,1-2,5,9H2,(H,22,24)
InChIKeyLQACVGSVBBHRSL-UHFFFAOYSA-N
XLogP3.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.30
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide?
The IUPAC name of 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide (CID 37197085) is 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide.
What is the SMILES notation for 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide?
The canonical SMILES for 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide is O=C(CN1CCCc2c(F)cc(F)cc21)Nc1cc(F)ccc1F.
What is the InChIKey of 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide?
The InChIKey is LQACVGSVBBHRSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F4N2O/c18-10-3-4-13(20)15(7-10)22-17(24)9-23-5-1-2-12-14(21)6-11(19)8-16(12)23/h3-4,6-8H,1-2,5,9H2,(H,22,24).
What are the key properties of 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide?
2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide has a molecular weight of 338.30 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide is sourced from PubChem (CID 37197085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).