Chemical ID: 4243924

CCN(CC)C(=O)CC(c1ccccc1)c2ccc(cc2)OC(C)C
Chemical ID:
4243924
Name [?]:
N,N-diethyl-3-(4-isopropoxyphenyl)-3-phenyl-propanamide
SMILES [?]:
CCN(CC)C(=O)CC(c1ccccc1)c2ccc(cc2)OC(C)C
InChi [?]:
InChI=1/C22H29NO2/c1-5-23(6-2)22(24)16-21(18-10-8-7-9-11-18)19-12-14-20(15-13-19)25-17(3)4/h7-15,17,21H,5-6,16H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,5,24,25,2,4,13,12,14,11,15,17,21,18,20,8,23,10,16,19,9,6,3,7,22/E:(1,2)(3,4)(5,6)(8,9)(10,11)(12,13)(14,15)/rA:25cCCNCCCOCCCCCCCCCCCCCCOCCC/rB:s1;s2;s3;s4;s3;d6;s6;s8;s9;s10;d11;s12;d13;d10s14;s9;s16;d17;s18;d19;d16s20;s19;s22;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H29NO2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:11.1237
Area:581.541
Solvation:-3.41479
Coulombic:-25.8308
Bond Count [?]
All:26
Single:19
Double:7
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:339.471
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.68
LogP (Chemaxon):4.44

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