Compound Summary
Compound Information
EIPA
Compound Name: | EIPA |
Compound CID: | 1795 |
Synonyms: | EIPA |
Iupac Name: | 3-amino-6-chloro-N-(diaminomethylidene)-5-[ethyl(propan-2-yl)amino]pyrazine-2-carboxamide |
InChI: | InChI=1S/C11H18ClN7O/c1-4-19(5(2)3)9-7(12)16-6(8(13)17-9)10(20)18-11(14)15/h5H,4H2,1-3H3,(H2,13,17)(H4,14,15,18,20) |
InChIKey: | QDERNBXNXJCIQK-UHFFFAOYSA-N |
Canonical Smiles: | CCN(C1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N)C(C)C |
Isomeric Smiles: | CCN(C1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N)C(C)C |
Molecular Weight: | 299.76 |
Molecular Formula: | C11H18ClN7O |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
EIPA
Molecular Weight: | 299.76 |
Molecular Formula: | C11H18ClN7O |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 20 |
Complexity: | 372 |
Synonyms
EIPA
Experimental Data
EIPA
Experimental Data Visualization
EIPA
Statistics Data
EIPA
Statistics Data Visualization
EIPA
