2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine

C9H8F3N — CID 131131432

IUPAC2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESFC(F)(F)c1ccc2c(n1)CCC2
InChIInChI=1S/C9H8F3N/c10-9(11,12)8-5-4-6-2-1-3-7(6)13-8/h4-5H,1-3H2
InChIKeyDRNFMLVCIYOYMP-UHFFFAOYSA-N
MW187.16 g/mol
LogP2.59
Rot. Bonds

About 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine

2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 131131432) has the molecular formula C9H8F3N and a molecular weight of 187.16 g/mol. Its IUPAC name is 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID131131432
Molecular FormulaC9H8F3N
Molecular Weight187.16 g/mol
Exact Mass187.06
IUPAC Name2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESFC(F)(F)c1ccc2c(n1)CCC2
InChIInChI=1S/C9H8F3N/c10-9(11,12)8-5-4-6-2-1-3-7(6)13-8/h4-5H,1-3H2
InChIKeyDRNFMLVCIYOYMP-UHFFFAOYSA-N
XLogP2.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.16
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The IUPAC name of 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 131131432) is 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine.
What is the SMILES notation for 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The canonical SMILES for 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine is FC(F)(F)c1ccc2c(n1)CCC2.
What is the InChIKey of 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The InChIKey is DRNFMLVCIYOYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N/c10-9(11,12)8-5-4-6-2-1-3-7(6)13-8/h4-5H,1-3H2.
What are the key properties of 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine?
2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 187.16 g/mol, XLogP of 2.59, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 131131432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).