1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine

C15H13BrFN3 — CID 84745050

IUPAC1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine
SMILESCN(C)c1cccn2c(-c3ccccc3F)nc(Br)c12
InChIInChI=1S/C15H13BrFN3/c1-19(2)12-8-5-9-20-13(12)14(16)18-15(20)10-6-3-4-7-11(10)17/h3-9H,1-2H3
InChIKeyQSTDVCKLJUEPCO-UHFFFAOYSA-N
MW334.19 g/mol
LogP3.97
Rot. Bonds2

About 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine

1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine (PubChem CID 84745050) has the molecular formula C15H13BrFN3 and a molecular weight of 334.19 g/mol. Its IUPAC name is 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine
PubChem CID84745050
Molecular FormulaC15H13BrFN3
Molecular Weight334.19 g/mol
Exact Mass333.03
IUPAC Name1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine
SMILESCN(C)c1cccn2c(-c3ccccc3F)nc(Br)c12
InChIInChI=1S/C15H13BrFN3/c1-19(2)12-8-5-9-20-13(12)14(16)18-15(20)10-6-3-4-7-11(10)17/h3-9H,1-2H3
InChIKeyQSTDVCKLJUEPCO-UHFFFAOYSA-N
XLogP3.97
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.19
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine?
The IUPAC name of 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine (CID 84745050) is 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine?
The canonical SMILES for 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine is CN(C)c1cccn2c(-c3ccccc3F)nc(Br)c12.
What is the InChIKey of 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine?
The InChIKey is QSTDVCKLJUEPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFN3/c1-19(2)12-8-5-9-20-13(12)14(16)18-15(20)10-6-3-4-7-11(10)17/h3-9H,1-2H3.
What are the key properties of 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine?
1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine has a molecular weight of 334.19 g/mol, XLogP of 3.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(2-fluorophenyl)-N,N-dimethylimidazo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 84745050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).