Chemical ID: 6039104

CCC(C)N(CCC(=O)NC(C)C)C(=O)c1cnccn1
Chemical ID:
6039104
Name [?]:
N-[2-(isopropylcarbamoyl)ethyl]-N-sec-butyl-pyrazine-2-carboxamide
SMILES [?]:
CCC(C)N(CCC(=O)NC(C)C)C(=O)c1cnccn1
InChi [?]:
InChI=1/C15H24N4O2/c1-5-12(4)19(9-6-14(20)18-11(2)3)15(21)13-10-16-7-8-17-13/h7-8,10-12H,5-6,9H2,1-4H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,12,13,4,2,7,19,20,6,17,11,3,16,8,14,18,21,10,5,9,15/E:(2,3)/rA:21cCCCCNCCCONCCCCOCCNCCN/rB:s1;s2;s3;s3;s5;s6;s7;d8;s8;s10;s11;s11;s5;d14;s14;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N4O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:9.6533
Area:504.534
Solvation:-2.96005
Coulombic:-48.1217
Bond Count [?]
All:21
Single:16
Double:5
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:292.377
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.09
LogP (Chemaxon):0.05

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