1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol

C13H16BrN3O — CID 117254727

IUPAC1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol
SMILESOc1cccn2c(CC3CCCCN3)nc(Br)c12
InChIInChI=1S/C13H16BrN3O/c14-13-12-10(18)5-3-7-17(12)11(16-13)8-9-4-1-2-6-15-9/h3,5,7,9,15,18H,1-2,4,6,8H2
InChIKeyGDESSFZCVYQXKU-UHFFFAOYSA-N
MW310.19 g/mol
LogP2.49
Rot. Bonds2

About 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol

1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol (PubChem CID 117254727) has the molecular formula C13H16BrN3O and a molecular weight of 310.19 g/mol. Its IUPAC name is 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol.

Molecular Properties

Compound Name1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol
PubChem CID117254727
Molecular FormulaC13H16BrN3O
Molecular Weight310.19 g/mol
Exact Mass309.05
IUPAC Name1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol
SMILESOc1cccn2c(CC3CCCCN3)nc(Br)c12
InChIInChI=1S/C13H16BrN3O/c14-13-12-10(18)5-3-7-17(12)11(16-13)8-9-4-1-2-6-15-9/h3,5,7,9,15,18H,1-2,4,6,8H2
InChIKeyGDESSFZCVYQXKU-UHFFFAOYSA-N
XLogP2.49
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.19
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-bromo-8-chloro-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine
CID 117254720
1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine
CID 117254735
8-bromo-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 84744210
8-methoxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254731
methyl 8-methoxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254732
1-bromo-6-chloro-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine
CID 84744462
methyl 8-amino-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254722
1-bromo-8-methyl-3-(piperidin-3-ylmethyl)imidazo[1,5-a]pyridine
CID 117254803
3-(3-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-8-ol
CID 117255001
6-(piperidin-2-ylmethyl)imidazo[1,5-a]pyrimidine
CID 105470149
8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine
CID 115039507
methyl 3-(piperidin-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylate
CID 117147604

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol?
The IUPAC name of 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol (CID 117254727) is 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol.
What is the SMILES notation for 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol?
The canonical SMILES for 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol is Oc1cccn2c(CC3CCCCN3)nc(Br)c12.
What is the InChIKey of 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol?
The InChIKey is GDESSFZCVYQXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN3O/c14-13-12-10(18)5-3-7-17(12)11(16-13)8-9-4-1-2-6-15-9/h3,5,7,9,15,18H,1-2,4,6,8H2.
What are the key properties of 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol?
1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol has a molecular weight of 310.19 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol is sourced from PubChem (CID 117254727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).