Chemical ID: 6345511

CCc1cccc(c1NC(=O)C2CC2)C
Chemical ID:
6345511
Name [?]:
N-(2-ethyl-6-methyl-phenyl)cyclopropanecarboxamide
SMILES [?]:
CCc1cccc(c1NC(=O)C2CC2)C
InChi [?]:
InChI=1/C13H17NO/c1-3-10-6-4-5-9(2)12(10)14-13(15)11-7-8-11/h4-6,11H,3,7-8H2,1-2H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,15,2,5,6,4,13,14,7,3,12,8,10,9,11/E:(7,8)/rA:15nCCCCCCCCNCOCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s12s13;s7;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H17NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.79302
Area:383.782
Solvation:-1.80153
Coulombic:-20.9034
Bond Count [?]
All:16
Single:12
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:203.28
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.4
LogP (Chemaxon):2.09

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Descriptor Annotations

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