1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine

C12H14BrN3 — CID 117250339

IUPAC1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
SMILESCN1CCC(c2nc(Br)c3ccccn23)C1
InChIInChI=1S/C12H14BrN3/c1-15-7-5-9(8-15)12-14-11(13)10-4-2-3-6-16(10)12/h2-4,6,9H,5,7-8H2,1H3
InChIKeyJZFANRLFSDMQLQ-UHFFFAOYSA-N
MW280.17 g/mol
LogP2.52
Rot. Bonds1

About 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine

1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine (PubChem CID 117250339) has the molecular formula C12H14BrN3 and a molecular weight of 280.17 g/mol. Its IUPAC name is 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
PubChem CID117250339
Molecular FormulaC12H14BrN3
Molecular Weight280.17 g/mol
Exact Mass279.04
IUPAC Name1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
SMILESCN1CCC(c2nc(Br)c3ccccn23)C1
InChIInChI=1S/C12H14BrN3/c1-15-7-5-9(8-15)12-14-11(13)10-4-2-3-6-16(10)12/h2-4,6,9H,5,7-8H2,1H3
InChIKeyJZFANRLFSDMQLQ-UHFFFAOYSA-N
XLogP2.52
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.17
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117250338
1-bromo-7-methyl-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117251632
1-[4-(1-bromoimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]ethanone
CID 84604743
1-bromo-3-piperidin-4-ylimidazo[1,5-a]pyridine
CID 84743441
tert-butyl 3-(1-bromoimidazo[1,5-a]pyridin-3-yl)piperidine-1-carboxylate
CID 171544233
1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridine
CID 84743442
8-methyl-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117146223
1-bromo-8-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744303
1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
CID 117252249
1-bromo-5-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744309
1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridin-8-ol
CID 117252180
3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117147381

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine (CID 117250339) is 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine is CN1CCC(c2nc(Br)c3ccccn23)C1.
What is the InChIKey of 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine?
The InChIKey is JZFANRLFSDMQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3/c1-15-7-5-9(8-15)12-14-11(13)10-4-2-3-6-16(10)12/h2-4,6,9H,5,7-8H2,1H3.
What are the key properties of 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine?
1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine has a molecular weight of 280.17 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 117250339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).