Chemical ID: 6536438

c1cc(cc(c1)[N+](=O)[O-])NC(=O)C23CCC(C2)CC3
Chemical ID:
6536438
Name [?]:
N-(3-nitrophenyl)norbornane-1-carboxamide
SMILES [?]:
c1cc(cc(c1)[N+](=O)[O-])NC(=O)C23CCC(C2)CC3
InChi [?]:
InChI=1/C14H16N2O3/c17-13(14-6-4-10(9-14)5-7-14)15-11-2-1-3-12(8-11)16(18)19/h1-3,8,10H,4-7,9H2,(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,2,6,15,18,14,19,4,17,16,3,5,11,13,10,7,12,8,9/E:(4,5)(6,7)(18,19)/CRV:16.5/rA:19nCCCCCCN+OO-NCOCCCCCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s3;s10;d11;s11;s13;s14;s15;s13s16;s16;s13s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H16N2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:4.12229
Area:439.883
Solvation:-6.87478
Coulombic:-32.8524
Bond Count [?]
All:21
Single:16
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:260.289
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.76
LogP (Chemaxon):3.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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