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Chemical ID: 6388924
Chemical ID:
6388924
Name [?]:
(4-methylpiperazin-1-yl)-pyrazin-2-yl-methanone
SMILES [?]:
CN1CCN(CC1)C(=O)c2cnccn2
InChi [?]:
InChI=1/C10H14N4O/c1-13-4-6-14(7-5-13)10(15)9-8-11-2-3-12-9/h2-3,8H,4-7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,13,14,3,7,4,6,11,10,8,12,15,2,5,9/E:(4,5)(6,7)/rA:15nCNCCNCCCOCCNCCN/rB:s1;s2;s3;s4;s5;s2s6;s5;d8;s8;s10;d11;s12;d13;d10s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H14N4O |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.83736 |
Area: | 369.763 |
Solvation: | -2.40672 |
Coulombic: | -32.0136 |
Bond Count [?]
All: | 16 |
Single: | 12 |
Double: | 4 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 206.245 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 3 |
XLogP: | -0.72 |
LogP (Chemaxon): | -1.23 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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