8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine

C12H14N6 — CID 80854230

IUPAC8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(-n2ccnc2)n1
InChIInChI=1S/C12H14N6/c1-2-3-14-10-8-17-7-5-15-11(17)12(16-10)18-6-4-13-9-18/h4-9,14H,2-3H2,1H3
InChIKeyMJVVTOPDXQDTFO-UHFFFAOYSA-N
MW242.29 g/mol
LogP1.74
Rot. Bonds4

About 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine

8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80854230) has the molecular formula C12H14N6 and a molecular weight of 242.29 g/mol. Its IUPAC name is 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80854230
Molecular FormulaC12H14N6
Molecular Weight242.29 g/mol
Exact Mass242.13
IUPAC Name8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(-n2ccnc2)n1
InChIInChI=1S/C12H14N6/c1-2-3-14-10-8-17-7-5-15-11(17)12(16-10)18-6-4-13-9-18/h4-9,14H,2-3H2,1H3
InChIKeyMJVVTOPDXQDTFO-UHFFFAOYSA-N
XLogP1.74
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine (CID 80854230) is 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine is CCCNc1cn2ccnc2c(-n2ccnc2)n1.
What is the InChIKey of 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is MJVVTOPDXQDTFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6/c1-2-3-14-10-8-17-7-5-15-11(17)12(16-10)18-6-4-13-9-18/h4-9,14H,2-3H2,1H3.
What are the key properties of 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine?
8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 242.29 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80854230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).