8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine

C12H18N6 — CID 80824349

IUPAC8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCN(CCNc1nc(N)cn2ccnc12)C1CC1
InChIInChI=1S/C12H18N6/c1-17(9-2-3-9)6-4-14-11-12-15-5-7-18(12)8-10(13)16-11/h5,7-9H,2-4,6,13H2,1H3,(H,14,16)
InChIKeyARBVKTBTZDDIIQ-UHFFFAOYSA-N
MW246.32 g/mol
LogP0.82
Rot. Bonds5

About 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine

8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80824349) has the molecular formula C12H18N6 and a molecular weight of 246.32 g/mol. Its IUPAC name is 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80824349
Molecular FormulaC12H18N6
Molecular Weight246.32 g/mol
Exact Mass246.16
IUPAC Name8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCN(CCNc1nc(N)cn2ccnc12)C1CC1
InChIInChI=1S/C12H18N6/c1-17(9-2-3-9)6-4-14-11-12-15-5-7-18(12)8-10(13)16-11/h5,7-9H,2-4,6,13H2,1H3,(H,14,16)
InChIKeyARBVKTBTZDDIIQ-UHFFFAOYSA-N
XLogP0.82
TPSA71.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.32
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine (CID 80824349) is 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine is CN(CCNc1nc(N)cn2ccnc12)C1CC1.
What is the InChIKey of 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is ARBVKTBTZDDIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6/c1-17(9-2-3-9)6-4-14-11-12-15-5-7-18(12)8-10(13)16-11/h5,7-9H,2-4,6,13H2,1H3,(H,14,16).
What are the key properties of 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 246.32 g/mol, XLogP of 0.82, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80824349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).