1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine

C13H10BrClN2O — CID 84744807

IUPAC1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine
SMILESClc1ccc2c(Br)nc(CCc3ccco3)n2c1
InChIInChI=1S/C13H10BrClN2O/c14-13-11-5-3-9(15)8-17(11)12(16-13)6-4-10-2-1-7-18-10/h1-3,5,7-8H,4,6H2
InChIKeyLCDBNTQFRUPYFH-UHFFFAOYSA-N
MW325.59 g/mol
LogP4.13
Rot. Bonds3

About 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine

1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine (PubChem CID 84744807) has the molecular formula C13H10BrClN2O and a molecular weight of 325.59 g/mol. Its IUPAC name is 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine
PubChem CID84744807
Molecular FormulaC13H10BrClN2O
Molecular Weight325.59 g/mol
Exact Mass323.97
IUPAC Name1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine
SMILESClc1ccc2c(Br)nc(CCc3ccco3)n2c1
InChIInChI=1S/C13H10BrClN2O/c14-13-11-5-3-9(15)8-17(11)12(16-13)6-4-10-2-1-7-18-10/h1-3,5,7-8H,4,6H2
InChIKeyLCDBNTQFRUPYFH-UHFFFAOYSA-N
XLogP4.13
TPSA30.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.59
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-3-[2-(furan-2-yl)ethyl]-N,N-dimethylimidazo[1,5-a]pyridin-5-amine
CID 84745054
2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine
CID 84744625
1-bromo-3-[2-(2-fluorophenyl)ethyl]-6-methylimidazo[1,5-a]pyridine
CID 84745023
6-chloro-2-(2-chloroethyl)-1-[2-(furan-2-yl)ethyl]benzimidazole
CID 115471213
3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile
CID 28752154
1-bromo-3-(furan-2-ylmethyl)imidazo[1,5-a]pyridin-5-amine
CID 117250918
1-[3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridin-1-yl]-N-methylmethanamine
CID 28797139
6-chloro-3-[2-(furan-2-yl)ethyl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 43144335
2-chloro-4-ethoxy-6-[2-(furan-2-yl)ethyl]-1,3,5-triazine
CID 58039750
2-(1-bromo-3-ethylimidazo[1,5-a]pyridin-6-yl)ethanamine
CID 83867344
6-chloro-3-(2-hydroxyethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117253410
2-(2-chloroethyl)-5-fluoro-1-[2-(furan-2-yl)ethyl]-6-methylbenzimidazole
CID 103593513

Frequently Asked Questions

What is the IUPAC name of 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine (CID 84744807) is 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine is Clc1ccc2c(Br)nc(CCc3ccco3)n2c1.
What is the InChIKey of 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine?
The InChIKey is LCDBNTQFRUPYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrClN2O/c14-13-11-5-3-9(15)8-17(11)12(16-13)6-4-10-2-1-7-18-10/h1-3,5,7-8H,4,6H2.
What are the key properties of 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine?
1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine has a molecular weight of 325.59 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-6-chloro-3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 84744807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).