8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine

C13H19N5 — CID 80782305

IUPAC8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(NC(C)C2CC2)n1
InChIInChI=1S/C13H19N5/c1-3-14-11-8-18-7-6-15-13(18)12(17-11)16-9(2)10-4-5-10/h6-10,14H,3-5H2,1-2H3,(H,16,17)
InChIKeyQVORSXVNKWVATJ-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.37
Rot. Bonds5

About 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine

8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80782305) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80782305
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(NC(C)C2CC2)n1
InChIInChI=1S/C13H19N5/c1-3-14-11-8-18-7-6-15-13(18)12(17-11)16-9(2)10-4-5-10/h6-10,14H,3-5H2,1-2H3,(H,16,17)
InChIKeyQVORSXVNKWVATJ-UHFFFAOYSA-N
XLogP2.37
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine (CID 80782305) is 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine is CCNc1cn2ccnc2c(NC(C)C2CC2)n1.
What is the InChIKey of 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is QVORSXVNKWVATJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-3-14-11-8-18-7-6-15-13(18)12(17-11)16-9(2)10-4-5-10/h6-10,14H,3-5H2,1-2H3,(H,16,17).
What are the key properties of 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 245.33 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(1-cyclopropylethyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80782305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).