N-[2-(4-methoxyphenyl)ethyl]-3,3,3-triphenylpropanamide

Update Time: 2025-04-25 16:31:57

	Common Name	N-[2-(4-methoxyphenyl)ethyl]-3,3,3-triphenylpropanamide	English Name	N-[2-(4-methoxyphenyl)ethyl]-3,3,3-triphenylpropanamide
	CAS NO.	N/A	Molecular Weight	435.6
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₃₀H₂₉NO₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	N-[2-(4-methoxyphenyl)ethyl]-3,3,3-triphenylpropanamide

Molecular Formula	C30H29NO2
Molecular Weight	435.6
Exact Mass	435.219829168
LogP	6.50
Standard SMILES	COc1ccc(CCNC(=O)CC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
Canonical SMILES	COC1=CC=C(C=C1)CCNC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Isomeric SMILES	COC1=CC=C(C=C1)CCNC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Standard InChI Identifier	InChI=1S/C30H29NO2/c1-33-28-19-17-24(18-20-28)21-22-31-29(32)23-30(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-20H,21-23H2,1H3,(H,31,32)
Standard InChI Key	YYYUTKHVRPFLBF-UHFFFAOYSA-N
Compound Complexity	518.00
computational chemistry	Hydrogen Bond Acceptor Count：2 Hydrogen Bond Donor Count：1 Rotatable Bond Count：9 Heavy Atom Count：33 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：435.219829168