3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol

C11H13BrN4O — CID 67096147

IUPAC3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol
SMILESCC1(O)CC(c2nc(Br)c3cncc(N)n23)C1
InChIInChI=1S/C11H13BrN4O/c1-11(17)2-6(3-11)10-15-9(12)7-4-14-5-8(13)16(7)10/h4-6,17H,2-3,13H2,1H3
InChIKeyMXPLEEJUKRNRFY-UHFFFAOYSA-N
MW297.16 g/mol
LogP1.70
Rot. Bonds1

About 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol

3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol (PubChem CID 67096147) has the molecular formula C11H13BrN4O and a molecular weight of 297.16 g/mol. Its IUPAC name is 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol.

Molecular Properties

Compound Name3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol
PubChem CID67096147
Molecular FormulaC11H13BrN4O
Molecular Weight297.16 g/mol
Exact Mass296.03
IUPAC Name3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol
SMILESCC1(O)CC(c2nc(Br)c3cncc(N)n23)C1
InChIInChI=1S/C11H13BrN4O/c1-11(17)2-6(3-11)10-15-9(12)7-4-14-5-8(13)16(7)10/h4-6,17H,2-3,13H2,1H3
InChIKeyMXPLEEJUKRNRFY-UHFFFAOYSA-N
XLogP1.70
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.16
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(8-Chloroimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutanol
CID 53328619
3-(1-Bromo-8-chloroimidazo[1,5-A]pyrazin-3-YL)-1-methylcyclobutanol
CID 53328622
cis-3-(8-Amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutanol
CID 53328623
3-(8-Amino-1-iodoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutanol
CID 53328977
1-Bromo-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine
CID 57680934
3-(8-Amino-1-iodoimidazo[1,5-a]pyrazin-3-yl)cyclobutanol
CID 57681085
1-(8-Amino-1-iodoimidazo[1,5-a]pyrazin-3-yl)cyclobutan-1-ol
CID 67368095
1-(5-Amino-1-iodoimidazo[1,5-a]pyrazin-3-yl)cyclobutan-1-ol
CID 67368096
1-Bromo-3-(3-methylcyclobutyl)imidazo[1,5-a]pyrazin-8-amine
CID 68203015
(4S)-4-(8-amino-1-iodoimidazo[1,5-a]pyrazin-3-yl)-2-methylpentan-2-ol
CID 69945235
3-(3-Methylcyclobutyl)imidazo[1,5-a]pyrazin-8-amine
CID 70998692
3-(8-Amino-1-methylimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol
CID 71196524

Frequently Asked Questions

What is the IUPAC name of 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol?
The IUPAC name of 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol (CID 67096147) is 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol.
What is the SMILES notation for 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol?
The canonical SMILES for 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol is CC1(O)CC(c2nc(Br)c3cncc(N)n23)C1.
What is the InChIKey of 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol?
The InChIKey is MXPLEEJUKRNRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN4O/c1-11(17)2-6(3-11)10-15-9(12)7-4-14-5-8(13)16(7)10/h4-6,17H,2-3,13H2,1H3.
What are the key properties of 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol?
3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol has a molecular weight of 297.16 g/mol, XLogP of 1.70, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-methylcyclobutan-1-ol is sourced from PubChem (CID 67096147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).