Chemical ID: 7310124

COc1ccccc1NC(=O)CC2CC3CCC2C3
Chemical ID:
7310124
Name [?]:
N-(2-methoxyphenyl)-2-norbornan-2-yl-acetamide
SMILES [?]:
COc1ccccc1NC(=O)CC2CC3CCC2C3
InChi [?]:
InChI=1/C16H21NO2/c1-19-15-5-3-2-4-14(15)17-16(18)10-13-9-11-6-7-12(13)8-11/h2-5,11-13H,6-10H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,4,16,17,19,14,12,15,18,13,8,3,10,9,11,2/rA:19cCOCCCCCCNCOCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;s15;s16;s13s17;s15s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H21NO2
All Atoms:40
Heavy Atoms:19
Chiral Atoms:3
ZAP Information [?]
Total:8.51343
Area:446.933
Solvation:-2.6599
Coulombic:-29.162
Bond Count [?]
All:21
Single:17
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:259.343
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.0
LogP (Chemaxon):2.92

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue