8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine

C12H14N6O — CID 106390408

IUPAC8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCc1cnc(C(C)Nc2nc(N)cn3ccnc23)o1
InChIInChI=1S/C12H14N6O/c1-7-5-15-12(19-7)8(2)16-10-11-14-3-4-18(11)6-9(13)17-10/h3-6,8H,13H2,1-2H3,(H,16,17)
InChIKeyJJTXMVRYQZNGNL-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.78
Rot. Bonds3

About 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine

8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 106390408) has the molecular formula C12H14N6O and a molecular weight of 258.28 g/mol. Its IUPAC name is 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID106390408
Molecular FormulaC12H14N6O
Molecular Weight258.28 g/mol
Exact Mass258.12
IUPAC Name8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCc1cnc(C(C)Nc2nc(N)cn3ccnc23)o1
InChIInChI=1S/C12H14N6O/c1-7-5-15-12(19-7)8(2)16-10-11-14-3-4-18(11)6-9(13)17-10/h3-6,8H,13H2,1-2H3,(H,16,17)
InChIKeyJJTXMVRYQZNGNL-UHFFFAOYSA-N
XLogP1.78
TPSA94.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine (CID 106390408) is 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine is Cc1cnc(C(C)Nc2nc(N)cn3ccnc23)o1.
What is the InChIKey of 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is JJTXMVRYQZNGNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O/c1-7-5-15-12(19-7)8(2)16-10-11-14-3-4-18(11)6-9(13)17-10/h3-6,8H,13H2,1-2H3,(H,16,17).
What are the key properties of 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 258.28 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 106390408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).