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Chemical ID: 6358441
Chemical ID:
6358441
Name [?]:
N-(2-chlorophenyl)norbornane-2-carboxamide
SMILES [?]:
c1ccc(c(c1)NC(=O)C2CC3CCC2C3)Cl
InChi [?]:
InChI=1/C14H16ClNO/c15-12-3-1-2-4-13(12)16-14(17)11-8-9-5-6-10(11)7-9/h1-4,9-11H,5-8H2,(H,16,17)
InChi Info:
AuxInfo=1/1/N:2,1,3,6,13,14,16,11,12,15,10,4,5,8,17,7,9/rA:17cCCCCCCNCOCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;s12;s13;s10s14;s12s15;s4;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H16ClNO |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 3 |
ZAP Information [?]
Total: | 9.008 |
Area: | 414.616 |
Solvation: | -1.3574 |
Coulombic: | -22.7196 |
Bond Count [?]
All: | 19 |
Single: | 15 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 249.736 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 3.92 |
LogP (Chemaxon): | 2.88 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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