N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]hexanamide

Update Time: 2025-04-25 16:51:01

	Common Name	N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]hexanamide	English Name	N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]hexanamide
	CAS NO.	N/A	Molecular Weight	316.32
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₅H₁₉F₃N₂O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]hexanamide

Molecular Formula	C15H19F3N2O2
Molecular Weight	316.32
Exact Mass	316.13986234
LogP	3.20
Standard SMILES	CCCCCC(=O)NCC(=O)Nc1ccc(C(F)(F)F)cc1
Canonical SMILES	CCCCCC(=O)NCC(=O)NC1=CC=C(C=C1)C(F)(F)F
Isomeric SMILES	CCCCCC(=O)NCC(=O)NC1=CC=C(C=C1)C(F)(F)F
Standard InChI Identifier	InChI=1S/C15H19F3N2O2/c1-2-3-4-5-13(21)19-10-14(22)20-12-8-6-11(7-9-12)15(16,17)18/h6-9H,2-5,10H2,1H3,(H,19,21)(H,20,22)
Standard InChI Key	UHPGRUILJWRMTJ-UHFFFAOYSA-N
Compound Complexity	364.00
computational chemistry	Hydrogen Bond Acceptor Count：5 Hydrogen Bond Donor Count：2 Rotatable Bond Count：7 Heavy Atom Count：22 Total Chiral Atom Count：0 Defined Chiral Atom Count：0 Undefined Chiral Atom Count：0 Total Chiral Bond Count：0 Defined Chiral Bond Count：0 Undefined Chiral Bond Count：0 Isotope Atom Count：0 Covalent Unit Count：1 Tautomer Count：-1 Monoisotopic Mass：316.13986234