Chemical ID: 3963525

CCCC(=O)Nc1ccc(nc1)NC(=O)c2ccccc2
Chemical ID:
3963525
Name [?]:
N-(5-butanoylamino-2-pyridyl)benzamide
SMILES [?]:
CCCC(=O)Nc1ccc(nc1)NC(=O)c2ccccc2
InChi [?]:
InChI=1/C16H17N3O2/c1-2-6-15(20)18-13-9-10-14(17-11-13)19-16(21)12-7-4-3-5-8-12/h3-5,7-11H,2,6H2,1H3,(H,18,20)(H,17,19,21)
InChi Info:
AuxInfo=1/1/N:1,2,19,18,20,3,17,21,8,9,12,16,7,10,4,14,11,6,13,5,15/E:(4,5)(7,8)/rA:21nCCCCONCCCCNCNCOCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s10;s13;d14;s14;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H17N3O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.60931
Area:501.936
Solvation:-3.93909
Coulombic:-45.7402
Bond Count [?]
All:22
Single:14
Double:8
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:283.325
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.12
LogP (Chemaxon):2.84

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