Chemical ID: 6941060

CCOc1ccc(cc1)C(C)NC(=O)C(C)C
Chemical ID:
6941060
Name [?]:
N-[1-(4-ethoxyphenyl)ethyl]-2-methyl-propanamide
SMILES [?]:
CCOc1ccc(cc1)C(C)NC(=O)C(C)C
InChi [?]:
InChI=1/C14H21NO2/c1-5-17-13-8-6-12(7-9-13)11(4)15-14(16)10(2)3/h6-11H,5H2,1-4H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,16,17,11,2,6,8,5,9,15,10,7,4,13,12,14,3/E:(2,3)(6,7)(8,9)/rA:17cCCOCCCCCCCCNCOCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;s10;s12;d13;s13;s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO2
All Atoms:38
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:8.35687
Area:451.614
Solvation:-2.93349
Coulombic:-29.2326
Bond Count [?]
All:17
Single:13
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:235.322
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.83
LogP (Chemaxon):2.68

Name Annotations

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Descriptor Annotations

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