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Chemical ID: 6344375
Chemical ID:
6344375
Name [?]:
N-(2,6-diethylphenyl)norbornane-2-carboxamide
SMILES [?]:
CCc1cccc(c1NC(=O)C2CC3CCC2C3)CC
InChi [?]:
InChI=1/C18H25NO/c1-3-13-6-5-7-14(4-2)17(13)19-18(20)16-11-12-8-9-15(16)10-12/h5-7,12,15-16H,3-4,8-11H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,20,2,19,5,4,6,15,16,18,13,14,3,7,17,12,8,10,9,11/E:(1,2)(3,4)(6,7)(13,14)/rA:20cCCCCCCCCNCOCCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;s15;s12s16;s14s17;s7;s19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H25NO |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 3 |
ZAP Information [?]
Total: | 9.67088 |
Area: | 455.695 |
Solvation: | -1.72151 |
Coulombic: | -22.1995 |
Bond Count [?]
All: | 22 |
Single: | 18 |
Double: | 4 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 271.397 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 4.68 |
LogP (Chemaxon): | 3.44 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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