Chemical ID: 6346733

CCc1cccc(c1)NC(=O)C(C)C
Chemical ID:
6346733
Name [?]:
N-(3-ethylphenyl)-2-methyl-propanamide
SMILES [?]:
CCc1cccc(c1)NC(=O)C(C)C
InChi [?]:
InChI=1/C12H17NO/c1-4-10-6-5-7-11(8-10)13-12(14)9(2)3/h5-9H,4H2,1-3H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,13,14,2,5,4,6,8,12,3,7,10,9,11/E:(2,3)/rA:14nCCCCCCCCNCOCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;d10;s10;s12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17NO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.9471
Area:385.924
Solvation:-1.70101
Coulombic:-21.4882
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:191.27
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.72
LogP (Chemaxon):3.43

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