8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine

C12H19N5O — CID 80815585

IUPAC8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCN(c1nc(N)cn2ccnc12)C(C)COC
InChIInChI=1S/C12H19N5O/c1-4-17(9(2)8-18-3)12-11-14-5-6-16(11)7-10(13)15-12/h5-7,9H,4,8,13H2,1-3H3
InChIKeyUJAYSDXADQMKII-UHFFFAOYSA-N
MW249.32 g/mol
LogP1.17
Rot. Bonds5

About 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine

8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80815585) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80815585
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCN(c1nc(N)cn2ccnc12)C(C)COC
InChIInChI=1S/C12H19N5O/c1-4-17(9(2)8-18-3)12-11-14-5-6-16(11)7-10(13)15-12/h5-7,9H,4,8,13H2,1-3H3
InChIKeyUJAYSDXADQMKII-UHFFFAOYSA-N
XLogP1.17
TPSA68.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80815585) is 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine is CCN(c1nc(N)cn2ccnc12)C(C)COC.
What is the InChIKey of 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is UJAYSDXADQMKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-4-17(9(2)8-18-3)12-11-14-5-6-16(11)7-10(13)15-12/h5-7,9H,4,8,13H2,1-3H3.
What are the key properties of 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 249.32 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80815585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).