Chemical ID: 7422828

CC1(C2(CCC1(C(=O)C2=O)C(=O)Nc3ccc(cc3)F)C)C
Chemical ID:
7422828
Name [?]:
N-(4-fluorophenyl)-4,7,7-trimethyl-2,3-dioxo-norbornane-1-carboxamide
SMILES [?]:
CC1(C2(CCC1(C(=O)C2=O)C(=O)Nc3ccc(cc3)F)C)C
InChi [?]:
InChI=1/C17H18FNO3/c1-15(2)16(3)8-9-17(15,13(21)12(16)20)14(22)19-11-6-4-10(18)5-7-11/h4-7H,8-9H2,1-3H3,(H,19,22)
InChi Info:
AuxInfo=1/1/N:1,22,21,16,18,15,19,4,5,17,14,9,7,11,2,3,6,20,13,10,8,12/E:(1,2)(4,5)(6,7)/rA:22cCCCCCCCOCOCONCCCCCCFCC/rB:s1;s2;s3;s4;s2s5;s6;d7;s3s7;d9;s6;d11;s11;s13;s14;d15;s16;d17;d14s18;s17;s3;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18FNO3
All Atoms:40
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:7.35142
Area:462.124
Solvation:-4.20168
Coulombic:-40.0989
Bond Count [?]
All:24
Single:18
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:303.328
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.23
LogP (Chemaxon):4.83

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