Chemical ID: 7423856

CC1(C2CCC1(C(=O)C2=O)C(=O)Nc3ccccc3F)C
Chemical ID:
7423856
Name [?]:
N-(2-fluorophenyl)-7,7-dimethyl-2,3-dioxo-norbornane-1-carboxamide
SMILES [?]:
CC1(C2CCC1(C(=O)C2=O)C(=O)Nc3ccccc3F)C
InChi [?]:
InChI=1/C16H16FNO3/c1-15(2)9-7-8-16(15,13(20)12(9)19)14(21)18-11-6-4-3-5-10(11)17/h3-6,9H,7-8H2,1-2H3,(H,18,21)
InChi Info:
AuxInfo=1/1/N:1,21,17,16,18,15,4,5,3,19,14,9,7,11,2,6,20,13,10,8,12/E:(1,2)/rA:21cCCCCCCCOCOCONCCCCCCFC/rB:s1;s2;s3;s4;s2s5;s6;d7;s3s7;d9;s6;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s2;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16FNO3
All Atoms:37
Heavy Atoms:21
Chiral Atoms:2
ZAP Information [?]
Total:7.14055
Area:444.364
Solvation:-3.96854
Coulombic:-40.79
Bond Count [?]
All:23
Single:17
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:289.302
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.03
LogP (Chemaxon):3.52

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