Chemical ID: 4346034

CC(C)(C)NC(=O)c1cc2ccccc2o1
Chemical ID:
4346034
Name [?]:
N-tert-butylbenzofuran-2-carboxamide
SMILES [?]:
CC(C)(C)NC(=O)c1cc2ccccc2o1
InChi [?]:
InChI=1/C13H15NO2/c1-13(2,3)14-12(15)11-8-9-6-4-5-7-10(9)16-11/h4-8H,1-3H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,3,4,12,13,11,14,9,10,15,8,6,2,5,7,16/E:(1,2,3)/rA:16nCCCCNCOCCCCCCCCO/rB:s1;s2;s2;s2;s5;d6;s6;d8;s9;s10;d11;s12;d13;d10s14;s8s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H15NO2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.42006
Area:399.07
Solvation:-1.55668
Coulombic:-32.3509
Bond Count [?]
All:17
Single:12
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:217.264
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.78
LogP (Chemaxon):2.12

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