Chemical ID: 5814060

COc1ccc(cc1)NC(=O)c2cccnc2N3CCOCC3
Chemical ID:
5814060
Name [?]:
N-(4-methoxyphenyl)-2-morpholino-pyridine-3-carboxamide
SMILES [?]:
COc1ccc(cc1)NC(=O)c2cccnc2N3CCOCC3
InChi [?]:
InChI=1/C17H19N3O3/c1-22-14-6-4-13(5-7-14)19-17(21)15-3-2-8-18-16(15)20-9-11-23-12-10-20/h2-8H,9-12H2,1H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,14,13,5,7,4,8,15,19,23,20,22,6,3,12,17,10,16,9,18,11,2,21/E:(4,5)(6,7)(9,10)(11,12)/rA:23nCOCCCCCCNCOCCCCNCNCCOCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19N3O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.08978
Area:505.181
Solvation:-5.53974
Coulombic:-47.3191
Bond Count [?]
All:25
Single:18
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:313.351
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.19
LogP (Chemaxon):2.16

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