Chemical ID: 6039308

CCC(C)NC(=O)CCNC(=O)c1cnc(cn1)C
Chemical ID:
6039308
Name [?]:
5-methyl-N-[2-(sec-butylcarbamoyl)ethyl]pyrazine-2-carboxamide
SMILES [?]:
CCC(C)NC(=O)CCNC(=O)c1cnc(cn1)C
InChi [?]:
InChI=1/C13H20N4O2/c1-4-9(2)17-12(18)5-6-14-13(19)11-8-15-10(3)7-16-11/h7-9H,4-6H2,1-3H3,(H,14,19)(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,4,19,2,8,9,17,14,3,16,13,6,11,10,15,18,5,7,12/rA:19cCCCCNCOCCNCOCCNCCNC/rB:s1;s2;s3;s3;s5;d6;s6;s8;s9;s10;d11;s11;s13;d14;s15;d16;d13s17;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H20N4O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:9.25965
Area:496.824
Solvation:-3.16094
Coulombic:-51.8753
Bond Count [?]
All:19
Single:14
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:264.324
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:0.38
LogP (Chemaxon):-0.78

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