Chemical ID: 4688161

CC(C)(CCl)C(=O)Nc1ccc(cc1)N2CCOCC2
Chemical ID:
4688161
Name [?]:
3-chloro-2,2-dimethyl-N-(4-morpholinophenyl)-propanamide
SMILES [?]:
CC(C)(CCl)C(=O)Nc1ccc(cc1)N2CCOCC2
InChi [?]:
InChI=1/C15H21ClN2O2/c1-15(2,11-16)14(19)17-12-3-5-13(6-4-12)18-7-9-20-10-8-18/h3-6H,7-11H2,1-2H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,3,10,14,11,13,16,20,17,19,4,9,12,6,2,5,8,15,7,18/E:(1,2)(3,4)(5,6)(7,8)(9,10)/rA:20nCCCCClCONCCCCCCNCCOCC/rB:s1;s2;s2;s4;s2;d6;s6;s8;s9;d10;s11;d12;d9s13;s12;s15;s16;s17;s18;s15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21ClN2O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.61846
Area:488.915
Solvation:-3.6044
Coulombic:-35.5006
Bond Count [?]
All:21
Single:17
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.792
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.17
LogP (Chemaxon):3.29

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