Chemical ID: 4510561

c1cnccc1CNC(=O)C(=O)NC2CCCCCC2
Chemical ID:
4510561
Name [?]:
N'-cycloheptyl-N-(4-pyridylmethyl)oxamide
SMILES [?]:
c1cnccc1CNC(=O)C(=O)NC2CCCCCC2
InChi [?]:
InChI=1/C15H21N3O2/c19-14(17-11-12-7-9-16-10-8-12)15(20)18-13-5-3-1-2-4-6-13/h7-10,13H,1-6,11H2,(H,17,19)(H,18,20)
InChi Info:
AuxInfo=1/1/N:17,18,16,19,15,20,1,5,2,4,7,6,14,9,11,3,8,13,10,12/E:(1,2)(3,4)(5,6)(7,8)(9,10)/rA:20nCCNCCCCNCOCONCCCCCCC/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;d9;s9;d11;s11;s13;s14;s15;s16;s17;s18;s14s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21N3O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.86012
Area:489.729
Solvation:-2.38309
Coulombic:-52.179
Bond Count [?]
All:21
Single:16
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:275.346
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.75
LogP (Chemaxon):0.97

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