Chemical ID: 4211990

c1cc(cnc1)CNC(=O)C(=O)NC2CCCCCC2
Chemical ID:
4211990
Name [?]:
N'-cycloheptyl-N-(3-pyridylmethyl)oxamide
SMILES [?]:
c1cc(cnc1)CNC(=O)C(=O)NC2CCCCCC2
InChi [?]:
InChI=1/C15H21N3O2/c19-14(17-11-12-6-5-9-16-10-12)15(20)18-13-7-3-1-2-4-8-13/h5-6,9-10,13H,1-4,7-8,11H2,(H,17,19)(H,18,20)
InChi Info:
AuxInfo=1/1/N:17,18,16,19,1,2,15,20,6,4,7,3,14,9,11,5,8,13,10,12/E:(1,2)(3,4)(7,8)/rA:20nCCCCNCCNCOCONCCCCCCC/rB:s1;d2;s3;d4;d1s5;s3;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:9.92443
Area:490.901
Solvation:-2.34811
Coulombic:-52.3372
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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