8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine

C12H19N5O — CID 80841305

IUPAC8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCOCC(Nc1nc(N)cn2ccnc12)C(C)C
InChIInChI=1S/C12H19N5O/c1-8(2)9(7-18-3)15-11-12-14-4-5-17(12)6-10(13)16-11/h4-6,8-9H,7,13H2,1-3H3,(H,15,16)
InChIKeyYCTSWLCQQGWRJG-UHFFFAOYSA-N
MW249.32 g/mol
LogP1.39
Rot. Bonds5

About 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine

8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80841305) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80841305
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCOCC(Nc1nc(N)cn2ccnc12)C(C)C
InChIInChI=1S/C12H19N5O/c1-8(2)9(7-18-3)15-11-12-14-4-5-17(12)6-10(13)16-11/h4-6,8-9H,7,13H2,1-3H3,(H,15,16)
InChIKeyYCTSWLCQQGWRJG-UHFFFAOYSA-N
XLogP1.39
TPSA77.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutan-1-ol
CID 80848904
8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80838339
methyl 2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]acetate
CID 80776875
8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 113476564
8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 106390408
8-N-ethyl-8-N-(1-methoxypropan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80815585
2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-N-propylpropanamide
CID 80800872
6-hydrazinyl-N-(4-methoxybutan-2-yl)imidazo[1,2-a]pyrazin-8-amine
CID 80915322
8-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80807926
8-N-(3-ethylpentan-3-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80841859
8-N-[(1-methylimidazol-2-yl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80829250
8-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80848887

Frequently Asked Questions

What is the IUPAC name of 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80841305) is 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine is COCC(Nc1nc(N)cn2ccnc12)C(C)C.
What is the InChIKey of 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is YCTSWLCQQGWRJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-8(2)9(7-18-3)15-11-12-14-4-5-17(12)6-10(13)16-11/h4-6,8-9H,7,13H2,1-3H3,(H,15,16).
What are the key properties of 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 249.32 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80841305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).