1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine

C8H3Br2F3N2 — CID 84745242

IUPAC1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1nc(Br)c2cc(Br)ccn12
InChIInChI=1S/C8H3Br2F3N2/c9-4-1-2-15-5(3-4)6(10)14-7(15)8(11,12)13/h1-3H
InChIKeyYHKAYUCCNBENIE-UHFFFAOYSA-N
MW343.93 g/mol
LogP3.88
Rot. Bonds

About 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine

1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine (PubChem CID 84745242) has the molecular formula C8H3Br2F3N2 and a molecular weight of 343.93 g/mol. Its IUPAC name is 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine
PubChem CID84745242
Molecular FormulaC8H3Br2F3N2
Molecular Weight343.93 g/mol
Exact Mass341.86
IUPAC Name1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1nc(Br)c2cc(Br)ccn12
InChIInChI=1S/C8H3Br2F3N2/c9-4-1-2-15-5(3-4)6(10)14-7(15)8(11,12)13/h1-3H
InChIKeyYHKAYUCCNBENIE-UHFFFAOYSA-N
XLogP3.88
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.93
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,7-dibromo-3-methylimidazo[1,5-a]pyridine
CID 84743743
2-(1,7-dibromoimidazo[1,5-a]pyridin-3-yl)ethanol
CID 117253946
5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine
CID 82379830
7-bromo-3-methylimidazo[1,5-a]pyridin-1-amine
CID 83867392
[1-methyl-3-(trifluoromethyl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 83840161
1-bromo-7-chloro-3-methylimidazo[1,5-a]pyridine
CID 83900011
1-bromo-7-methylimidazo[1,5-a]pyridin-3-amine
CID 83867496
6-bromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743817
1-bromo-3-tert-butylimidazo[1,5-a]pyridine
CID 4738514
1-bromo-7-N,7-N-dimethylimidazo[1,5-a]pyridine-3,7-diamine
CID 83901116
1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine
CID 103596110
3-bromopyrido[1,2-a]benzimidazole
CID 132596716

Frequently Asked Questions

What is the IUPAC name of 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine (CID 84745242) is 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine is FC(F)(F)c1nc(Br)c2cc(Br)ccn12.
What is the InChIKey of 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine?
The InChIKey is YHKAYUCCNBENIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3Br2F3N2/c9-4-1-2-15-5(3-4)6(10)14-7(15)8(11,12)13/h1-3H.
What are the key properties of 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine?
1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine has a molecular weight of 343.93 g/mol, XLogP of 3.88, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 84745242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).