Chemical ID: 6386929

CCc1cccc(c1NC(=O)c2ccc(cc2)C)CC
Chemical ID:
6386929
Name [?]:
N-(2,6-diethylphenyl)-4-methyl-benzamide
SMILES [?]:
CCc1cccc(c1NC(=O)c2ccc(cc2)C)CC
InChi [?]:
InChI=1/C18H21NO/c1-4-14-7-6-8-15(5-2)17(14)19-18(20)16-11-9-13(3)10-12-16/h6-12H,4-5H2,1-3H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,20,18,2,19,5,4,6,14,16,13,17,15,3,7,12,8,10,9,11/E:(1,2)(4,5)(7,8)(9,10)(11,12)(14,15)/rA:20nCCCCCCCCNCOCCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;d13;s14;d15;d12s16;s15;s7;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.1885
Area:478.112
Solvation:-1.7643
Coulombic:-24.1095
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:267.365
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.81
LogP (Chemaxon):4.0

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Descriptor Annotations

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