Chemical ID: 6335102

CC(C)CC(=O)Nc1cccc2c1cccc2
Chemical ID:
6335102
Name [?]:
3-methyl-N-(1-naphthyl)butanamide
SMILES [?]:
CC(C)CC(=O)Nc1cccc2c1cccc2
InChi [?]:
InChI=1/C15H17NO/c1-11(2)10-15(17)16-14-9-5-7-12-6-3-4-8-13(12)14/h3-9,11H,10H2,1-2H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,3,16,15,10,17,11,14,9,4,2,12,13,8,5,7,6/E:(1,2)/rA:17nCCCCCONCCCCCCCCCC/rB:s1;s2;s2;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s13;d14;s15;s12d16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H17NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.56203
Area:416.912
Solvation:-1.86077
Coulombic:-22.3788
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:227.302
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.87
LogP (Chemaxon):3.73

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Descriptor Annotations

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