Chemical ID: 4232071

Cc1ccoc1C(=O)Nc2cccc(c2)OC(C)C
Chemical ID:
4232071
Name [?]:
N-(3-isopropoxyphenyl)-3-methyl-furan-2-carboxamide
SMILES [?]:
Cc1ccoc1C(=O)Nc2cccc(c2)OC(C)C
InChi [?]:
InChI=1/C15H17NO3/c1-10(2)19-13-6-4-5-12(9-13)16-15(17)14-11(3)7-8-18-14/h4-10H,1-3H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:18,19,1,12,11,13,3,4,15,17,2,10,14,6,7,9,8,5,16/E:(1,2)/rA:19nCCCCOCCONCCCCCCOCCC/rB:s1;s2;d3;s4;d2s5;s6;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;s16;s17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H17NO3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.6631
Area:460.166
Solvation:-2.84104
Coulombic:-38.1523
Bond Count [?]
All:20
Single:14
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:259.3
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.63
LogP (Chemaxon):3.02

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