1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C13H15BrN2O — CID 117250210

IUPAC1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCCn2c(Cc3ccco3)nc(Br)c21
InChIInChI=1S/C13H15BrN2O/c1-9-4-2-6-16-11(15-13(14)12(9)16)8-10-5-3-7-17-10/h3,5,7,9H,2,4,6,8H2,1H3
InChIKeyIWAWGNICWWRQAJ-UHFFFAOYSA-N
MW295.18 g/mol
LogP3.73
Rot. Bonds2

About 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 117250210) has the molecular formula C13H15BrN2O and a molecular weight of 295.18 g/mol. Its IUPAC name is 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID117250210
Molecular FormulaC13H15BrN2O
Molecular Weight295.18 g/mol
Exact Mass294.04
IUPAC Name1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCCn2c(Cc3ccco3)nc(Br)c21
InChIInChI=1S/C13H15BrN2O/c1-9-4-2-6-16-11(15-13(14)12(9)16)8-10-5-3-7-17-10/h3,5,7,9H,2,4,6,8H2,1H3
InChIKeyIWAWGNICWWRQAJ-UHFFFAOYSA-N
XLogP3.73
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.18
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine with MolForge

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Related Compounds

1-bromo-3-ethyl-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 83843433
1-(1-bromo-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)-N-methylmethanamine
CID 83867604
1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
CID 117249504
1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
CID 117249506
3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
CID 117151844
1-bromo-3-(furan-2-ylmethyl)imidazo[1,5-a]pyridin-5-amine
CID 117250918
3-(furan-2-yl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117152820
N-(furan-2-ylmethyl)-N,3-dimethylpiperidine-1-carboxamide
CID 116654269
N'-(furan-2-ylmethyl)-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 111022379
1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine
CID 169242230
1-(furan-2-ylmethyl)-N-methylpiperidin-4-amine;hydrochloride
CID 86253291
(3-ethyl-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol
CID 112552392

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 117250210) is 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC1CCCn2c(Cc3ccco3)nc(Br)c21.
What is the InChIKey of 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is IWAWGNICWWRQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2O/c1-9-4-2-6-16-11(15-13(14)12(9)16)8-10-5-3-7-17-10/h3,5,7,9H,2,4,6,8H2,1H3.
What are the key properties of 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 295.18 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 117250210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).