1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine

C12H13BrN4 — CID 117249828

IUPAC1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine
SMILESNC1CCCn2c(-c3ccccn3)nc(Br)c21
InChIInChI=1S/C12H13BrN4/c13-11-10-8(14)4-3-7-17(10)12(16-11)9-5-1-2-6-15-9/h1-2,5-6,8H,3-4,7,14H2
InChIKeyKFRRTNYCNKWPRO-UHFFFAOYSA-N
MW293.17 g/mol
LogP2.50
Rot. Bonds1

About 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine

1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine (PubChem CID 117249828) has the molecular formula C12H13BrN4 and a molecular weight of 293.17 g/mol. Its IUPAC name is 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine
PubChem CID117249828
Molecular FormulaC12H13BrN4
Molecular Weight293.17 g/mol
Exact Mass292.03
IUPAC Name1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine
SMILESNC1CCCn2c(-c3ccccn3)nc(Br)c21
InChIInChI=1S/C12H13BrN4/c13-11-10-8(14)4-3-7-17(10)12(16-11)9-5-1-2-6-15-9/h1-2,5-6,8H,3-4,7,14H2
InChIKeyKFRRTNYCNKWPRO-UHFFFAOYSA-N
XLogP2.50
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.17
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine with MolForge

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Related Compounds

3-(8-amino-1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol
CID 117249982
8-methoxycarbonyl-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249826
1-bromo-6-methyl-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117248475
1-bromo-8-methyl-3-(2-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117250064
3-pyridin-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 117152016
7-hydroxy-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249155
7-methyl-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249158
1-chloro-3-(furan-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine
CID 117249754
4-[(2R)-1-cyclopentylpyrrolidin-2-yl]-2-pyridin-2-ylpyrimidine
CID 95816040
(8R)-8-methyl-2-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 129462461
5-(1-methylpyrrolidin-2-yl)-2-pyridin-2-ylpyridine
CID 22298167
1-bromo-6-methyl-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 84743704

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine?
The IUPAC name of 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine (CID 117249828) is 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine?
The canonical SMILES for 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine is NC1CCCn2c(-c3ccccn3)nc(Br)c21.
What is the InChIKey of 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine?
The InChIKey is KFRRTNYCNKWPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN4/c13-11-10-8(14)4-3-7-17(10)12(16-11)9-5-1-2-6-15-9/h1-2,5-6,8H,3-4,7,14H2.
What are the key properties of 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine?
1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine has a molecular weight of 293.17 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 117249828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).