3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine

C15H13BrN2O — CID 117140557

IUPAC3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine
SMILESCOc1cccc2cnc(Cc3cccc(Br)c3)n12
InChIInChI=1S/C15H13BrN2O/c1-19-15-7-3-6-13-10-17-14(18(13)15)9-11-4-2-5-12(16)8-11/h2-8,10H,9H2,1H3
InChIKeyCQTYFWUIHPVFBM-UHFFFAOYSA-N
MW317.19 g/mol
LogP3.70
Rot. Bonds3

About 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine

3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine (PubChem CID 117140557) has the molecular formula C15H13BrN2O and a molecular weight of 317.19 g/mol. Its IUPAC name is 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine
PubChem CID117140557
Molecular FormulaC15H13BrN2O
Molecular Weight317.19 g/mol
Exact Mass316.02
IUPAC Name3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine
SMILESCOc1cccc2cnc(Cc3cccc(Br)c3)n12
InChIInChI=1S/C15H13BrN2O/c1-19-15-7-3-6-13-10-17-14(18(13)15)9-11-4-2-5-12(16)8-11/h2-8,10H,9H2,1H3
InChIKeyCQTYFWUIHPVFBM-UHFFFAOYSA-N
XLogP3.70
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.19
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-bromophenyl)methyl]imidazo[1,5-a]pyridin-5-ol
CID 117141950
2-(5-methoxyimidazo[1,5-a]pyridin-3-yl)ethanamine
CID 105445012
2-(5-methoxyimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine
CID 117140667
2-[(3-bromophenyl)methyl]-1-[(2,3-dimethoxyphenyl)methyl]imidazole
CID 82561895
1-(5-methoxyimidazo[1,5-a]pyridin-3-yl)-N-methylethanamine
CID 117253085
4-[2-(5-methoxyimidazo[1,5-a]pyridin-3-yl)ethyl]morpholine
CID 117140664
5-chloro-3-[(3-fluorophenyl)methyl]imidazo[1,5-a]pyridine
CID 117141951
3-[(5-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol
CID 117141968
3-[(1-ethylpyrrolidin-2-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine
CID 117140497
3-benzyl-5-chloroimidazo[1,5-a]pyridine
CID 117141926
7-methoxy-3-[(3-methoxyphenyl)methyl]imidazo[1,5-a]pyridine
CID 117143075
[4-[[2-[(3-bromophenyl)methyl]imidazol-1-yl]methyl]phenyl]methanamine
CID 82558174

Frequently Asked Questions

What is the IUPAC name of 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
The IUPAC name of 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine (CID 117140557) is 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
The canonical SMILES for 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine is COc1cccc2cnc(Cc3cccc(Br)c3)n12.
What is the InChIKey of 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
The InChIKey is CQTYFWUIHPVFBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O/c1-19-15-7-3-6-13-10-17-14(18(13)15)9-11-4-2-5-12(16)8-11/h2-8,10H,9H2,1H3.
What are the key properties of 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine has a molecular weight of 317.19 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-bromophenyl)methyl]-5-methoxyimidazo[1,5-a]pyridine is sourced from PubChem (CID 117140557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).