5-pyrrol-1-yl-2-(trifluoromethyl)pyridine

C10H7F3N2 — CID 82816701

IUPAC5-pyrrol-1-yl-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(-n2cccc2)cn1
InChIInChI=1S/C10H7F3N2/c11-10(12,13)9-4-3-8(7-14-9)15-5-1-2-6-15/h1-7H
InChIKeyFXLSOYLWYJBSGW-UHFFFAOYSA-N
MW212.17 g/mol
LogP2.89
Rot. Bonds1

About 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine

5-pyrrol-1-yl-2-(trifluoromethyl)pyridine (PubChem CID 82816701) has the molecular formula C10H7F3N2 and a molecular weight of 212.17 g/mol. Its IUPAC name is 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-pyrrol-1-yl-2-(trifluoromethyl)pyridine
PubChem CID82816701
Molecular FormulaC10H7F3N2
Molecular Weight212.17 g/mol
Exact Mass212.06
IUPAC Name5-pyrrol-1-yl-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(-n2cccc2)cn1
InChIInChI=1S/C10H7F3N2/c11-10(12,13)9-4-3-8(7-14-9)15-5-1-2-6-15/h1-7H
InChIKeyFXLSOYLWYJBSGW-UHFFFAOYSA-N
XLogP2.89
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine
CID 175981246
N-methyl-1-[1-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]methanamine
CID 114204439
5-(3-chloropyrazol-1-yl)-2-(trifluoromethyl)pyridine;ethane
CID 177229959
5-(3-methoxypyrazol-1-yl)-2-(trifluoromethyl)pyridine
CID 141441735
5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine
CID 157464435
5-(pyrazol-1-ylmethyl)-2-(trifluoromethyl)pyridine
CID 141098456
[1-[6-(trifluoromethyl)-3-pyridinyl]piperidin-4-yl]methanol
CID 169180436
[(3R)-1-[6-(trifluoromethyl)-3-pyridinyl]pyrrolidin-3-yl]methanol
CID 169180430
1-[6-(trifluoromethyl)-3-pyridinyl]-1,3-diazinan-2-one
CID 82817749
1-[6-(trifluoromethyl)-3-pyridinyl]-1,3-diazinane-2,4,6-trione
CID 112598156
(2S)-5-oxo-1-[6-(trifluoromethyl)-3-pyridinyl]pyrrolidine-2-carboxylic acid
CID 67456864
5-oxo-1-[6-(trifluoromethyl)-3-pyridinyl]pyrrolidine-2-carboxylic acid
CID 68755890

Frequently Asked Questions

What is the IUPAC name of 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine?
The IUPAC name of 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine (CID 82816701) is 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine is FC(F)(F)c1ccc(-n2cccc2)cn1.
What is the InChIKey of 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine?
The InChIKey is FXLSOYLWYJBSGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2/c11-10(12,13)9-4-3-8(7-14-9)15-5-1-2-6-15/h1-7H.
What are the key properties of 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine?
5-pyrrol-1-yl-2-(trifluoromethyl)pyridine has a molecular weight of 212.17 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrol-1-yl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 82816701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).