1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine

C9H2BrClF6N2 — CID 103596110

IUPAC1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1cc(Cl)c2c(Br)nc(C(F)(F)F)n2c1
InChIInChI=1S/C9H2BrClF6N2/c10-6-5-4(11)1-3(8(12,13)14)2-19(5)7(18-6)9(15,16)17/h1-2H
InChIKeyMGDZFBQJEKQIEZ-UHFFFAOYSA-N
MW367.47 g/mol
LogP4.79
Rot. Bonds

About 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine

1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine (PubChem CID 103596110) has the molecular formula C9H2BrClF6N2 and a molecular weight of 367.47 g/mol. Its IUPAC name is 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine
PubChem CID103596110
Molecular FormulaC9H2BrClF6N2
Molecular Weight367.47 g/mol
Exact Mass365.90
IUPAC Name1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1cc(Cl)c2c(Br)nc(C(F)(F)F)n2c1
InChIInChI=1S/C9H2BrClF6N2/c10-6-5-4(11)1-3(8(12,13)14)2-19(5)7(18-6)9(15,16)17/h1-2H
InChIKeyMGDZFBQJEKQIEZ-UHFFFAOYSA-N
XLogP4.79
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.47
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(bromomethyl)-8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 75176233
2-[8-chloro-2-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030290
8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 67335834
3,8-dichloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 151278989
3-bromo-8-chloro-2-(4-methoxyphenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 3720934
2-bromo-3-chloro-5-(trifluoromethyl)pyridine
CID 2736237
1-[8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclobutan-1-amine
CID 81161102
2-[8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]propan-1-amine
CID 62676097
8-chloro-3-propyl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 142870114
8-bromo-3-methyl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 83791604
8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonitrile
CID 59377305
N-[1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2,2,2-trifluoroethylidene]hydroxylamine
CID 126963652

Frequently Asked Questions

What is the IUPAC name of 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine (CID 103596110) is 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine is FC(F)(F)c1cc(Cl)c2c(Br)nc(C(F)(F)F)n2c1.
What is the InChIKey of 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
The InChIKey is MGDZFBQJEKQIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H2BrClF6N2/c10-6-5-4(11)1-3(8(12,13)14)2-19(5)7(18-6)9(15,16)17/h1-2H.
What are the key properties of 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine has a molecular weight of 367.47 g/mol, XLogP of 4.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-8-chloro-3,6-bis(trifluoromethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 103596110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).