Chemical ID: 6038873

CCN(CC)C(=O)CCN(CCc1ccccc1)C(=O)c2cnccn2
Chemical ID:
6038873
Name [?]:
N-[2-(diethylcarbamoyl)ethyl]-N-phenethyl-pyrazine-2-carboxamide
SMILES [?]:
CCN(CC)C(=O)CCN(CCc1ccccc1)C(=O)c2cnccn2
InChi [?]:
InChI=1/C20H26N4O2/c1-3-23(4-2)19(25)11-15-24(14-10-17-8-6-5-7-9-17)20(26)18-16-21-12-13-22-18/h5-9,12-13,16H,3-4,10-11,14-15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,4,16,15,17,14,18,12,8,24,25,11,9,22,13,21,6,19,23,26,3,10,7,20/E:(1,2)(3,4)(6,7)(8,9)/rA:26nCCNCCCOCCNCCCCCCCCCOCCNCCN/rB:s1;s2;s3;s4;s3;d6;s6;s8;s9;s10;s11;s12;s13;d14;s15;d16;d13s17;s10;d19;s19;s21;d22;s23;d24;d21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H26N4O2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.4917
Area:591.58
Solvation:-3.29777
Coulombic:-45.1666
Bond Count [?]
All:27
Single:19
Double:8
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:354.446
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.83
LogP (Chemaxon):1.03

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue