2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol

C10H15BrN2O — CID 117249561

IUPAC2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol
SMILESCC1CCCn2c(CCO)nc(Br)c21
InChIInChI=1S/C10H15BrN2O/c1-7-3-2-5-13-8(4-6-14)12-10(11)9(7)13/h7,14H,2-6H2,1H3
InChIKeyMCJAKSIJHSSNNU-UHFFFAOYSA-N
MW259.15 g/mol
LogP2.08
Rot. Bonds2

About 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol

2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol (PubChem CID 117249561) has the molecular formula C10H15BrN2O and a molecular weight of 259.15 g/mol. Its IUPAC name is 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol.

Molecular Properties

Compound Name2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol
PubChem CID117249561
Molecular FormulaC10H15BrN2O
Molecular Weight259.15 g/mol
Exact Mass258.04
IUPAC Name2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol
SMILESCC1CCCn2c(CCO)nc(Br)c21
InChIInChI=1S/C10H15BrN2O/c1-7-3-2-5-13-8(4-6-14)12-10(11)9(7)13/h7,14H,2-6H2,1H3
InChIKeyMCJAKSIJHSSNNU-UHFFFAOYSA-N
XLogP2.08
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.15
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol?
The IUPAC name of 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol (CID 117249561) is 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol.
What is the SMILES notation for 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol?
The canonical SMILES for 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol is CC1CCCn2c(CCO)nc(Br)c21.
What is the InChIKey of 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol?
The InChIKey is MCJAKSIJHSSNNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O/c1-7-3-2-5-13-8(4-6-14)12-10(11)9(7)13/h7,14H,2-6H2,1H3.
What are the key properties of 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol?
2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol has a molecular weight of 259.15 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)ethanol is sourced from PubChem (CID 117249561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).