1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine

C11H13BrN4 — CID 71226157

IUPAC1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine
SMILESCc1nccn2c(C3CCCN3)nc(Br)c12
InChIInChI=1S/C11H13BrN4/c1-7-9-10(12)15-11(8-3-2-4-14-8)16(9)6-5-13-7/h5-6,8,14H,2-4H2,1H3
InChIKeyXXRSRNFVXBJMSR-UHFFFAOYSA-N
MW281.16 g/mol
LogP2.22
Rot. Bonds1

About 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine

1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine (PubChem CID 71226157) has the molecular formula C11H13BrN4 and a molecular weight of 281.16 g/mol. Its IUPAC name is 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine
PubChem CID71226157
Molecular FormulaC11H13BrN4
Molecular Weight281.16 g/mol
Exact Mass280.03
IUPAC Name1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine
SMILESCc1nccn2c(C3CCCN3)nc(Br)c12
InChIInChI=1S/C11H13BrN4/c1-7-9-10(12)15-11(8-3-2-4-14-8)16(9)6-5-13-7/h5-6,8,14H,2-4H2,1H3
InChIKeyXXRSRNFVXBJMSR-UHFFFAOYSA-N
XLogP2.22
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-bromo-8-methoxy-3-pyrrolidin-2-ylimidazo[1,5-a]pyridine
CID 117254809
1-bromo-8-methyl-3-(4-piperazin-1-ylcyclohexyl)imidazo[1,5-a]pyrazine;hydrochloride
CID 67365898
1-bromo-3-pyrrolidin-2-ylimidazo[1,5-a]pyridin-6-ol
CID 117253655
1-methyl-2-pyrrolidin-2-ylimidazole;dihydrochloride
CID 71757802
1-bromo-6-chloro-3-pyrrolidin-2-ylimidazo[1,5-a]pyridine
CID 84744073
1-bromo-3-cyclopentylimidazo[1,5-a]pyrazin-8-amine
CID 71222909
1-bromo-3-pyrrolidin-2-ylimidazo[1,5-a]pyridin-5-amine
CID 117253057
8-bromo-3-methyl-2-pyrrolidin-2-ylimidazo[1,2-a]pyridine
CID 115051574
1-(4-phenylmethoxyphenyl)-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazin-8-amine
CID 146255696
2-[(2S)-pyrrolidin-2-yl]-1-[4-[4-[2-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]phenyl]phenyl]imidazole
CID 121349923
1-bromo-3-pyrrolidin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 116984576
4-(8-amino-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazin-1-yl)-N-(5-methyl-2-pyridinyl)benzamide;ethane
CID 145306186

Frequently Asked Questions

What is the IUPAC name of 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine?
The IUPAC name of 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine (CID 71226157) is 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine.
What is the SMILES notation for 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine?
The canonical SMILES for 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine is Cc1nccn2c(C3CCCN3)nc(Br)c12.
What is the InChIKey of 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine?
The InChIKey is XXRSRNFVXBJMSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN4/c1-7-9-10(12)15-11(8-3-2-4-14-8)16(9)6-5-13-7/h5-6,8,14H,2-4H2,1H3.
What are the key properties of 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine?
1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine has a molecular weight of 281.16 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-8-methyl-3-pyrrolidin-2-ylimidazo[1,5-a]pyrazine is sourced from PubChem (CID 71226157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).