Chemical ID: 6528452

Cc1cc(cc(c1)NC(=O)N2CCOCC2)C
Chemical ID:
6528452
Name [?]:
N-(3,5-dimethylphenyl)morpholine-4-carboxamide
SMILES [?]:
Cc1cc(cc(c1)NC(=O)N2CCOCC2)C
InChi [?]:
InChI=1/C13H18N2O2/c1-10-7-11(2)9-12(8-10)14-13(16)15-3-5-17-6-4-15/h7-9H,3-6H2,1-2H3,(H,14,16)
InChi Info:
AuxInfo=1/1/N:1,17,12,16,13,15,3,7,5,2,4,6,9,8,11,10,14/E:(1,2)(3,4)(5,6)(8,9)(10,11)/rA:17nCCCCCCCNCONCCOCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;s13;s14;s11s15;s4;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18N2O2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.424
Area:420.223
Solvation:-3.08158
Coulombic:-38.074
Bond Count [?]
All:18
Single:14
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:234.294
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.53
LogP (Chemaxon):2.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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