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

C9H4F6N2 — CID 162342835

IUPAC3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1cccn2c(C(F)(F)F)ncc12
InChIInChI=1S/C9H4F6N2/c10-8(11,12)5-2-1-3-17-6(5)4-16-7(17)9(13,14)15/h1-4H
InChIKeyUBHQVQWTYZCNSH-UHFFFAOYSA-N
MW254.13 g/mol
LogP3.37
Rot. Bonds

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

3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine (PubChem CID 162342835) has the molecular formula C9H4F6N2 and a molecular weight of 254.13 g/mol. Its IUPAC name is 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine
PubChem CID162342835
Molecular FormulaC9H4F6N2
Molecular Weight254.13 g/mol
Exact Mass254.03
IUPAC Name3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESFC(F)(F)c1cccn2c(C(F)(F)F)ncc12
InChIInChI=1S/C9H4F6N2/c10-8(11,12)5-2-1-3-17-6(5)4-16-7(17)9(13,14)15/h1-4H
InChIKeyUBHQVQWTYZCNSH-UHFFFAOYSA-N
XLogP3.37
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.13
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine (CID 162342835) is 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine is FC(F)(F)c1cccn2c(C(F)(F)F)ncc12.
What is the InChIKey of 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
The InChIKey is UBHQVQWTYZCNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H4F6N2/c10-8(11,12)5-2-1-3-17-6(5)4-16-7(17)9(13,14)15/h1-4H.
What are the key properties of 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine?
3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine has a molecular weight of 254.13 g/mol, XLogP of 3.37, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-bis(trifluoromethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 162342835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).