4-cyclopropyl-2-(trifluoromethyl)pyridine

C9H8F3N — CID 143990430

IUPAC4-cyclopropyl-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cc(C2CC2)ccn1
InChIInChI=1S/C9H8F3N/c10-9(11,12)8-5-7(3-4-13-8)6-1-2-6/h3-6H,1-2H2
InChIKeyJKJVZUPSHBEHMO-UHFFFAOYSA-N
MW187.16 g/mol
LogP2.98
Rot. Bonds1

About 4-cyclopropyl-2-(trifluoromethyl)pyridine

4-cyclopropyl-2-(trifluoromethyl)pyridine (PubChem CID 143990430) has the molecular formula C9H8F3N and a molecular weight of 187.16 g/mol. Its IUPAC name is 4-cyclopropyl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name4-cyclopropyl-2-(trifluoromethyl)pyridine
PubChem CID143990430
Molecular FormulaC9H8F3N
Molecular Weight187.16 g/mol
Exact Mass187.06
IUPAC Name4-cyclopropyl-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cc(C2CC2)ccn1
InChIInChI=1S/C9H8F3N/c10-9(11,12)8-5-7(3-4-13-8)6-1-2-6/h3-6H,1-2H2
InChIKeyJKJVZUPSHBEHMO-UHFFFAOYSA-N
XLogP2.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.16
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-[4-[2-(trifluoromethyl)-4-pyridinyl]cyclohexyl]-2-thia-8-azaspiro[3.5]nonane
CID 168907245
4-fluoro-2-(trifluoromethyl)pyridine
CID 44891496
2-(trifluoromethyl)pyridin-4-amine
CID 10261388
5-cyclobutyl-2-(trifluoromethyl)pyridine
CID 167467785
1-cyclopropyl-3-(trifluoromethyl)benzene
CID 12509713
2-fluoro-4-(oxan-4-yl)pyridine
CID 58548478
5-cyclohexyl-2-(trifluoromethyl)pyridine
CID 138976575
N-chloro-1-[2-(trifluoromethyl)-4-pyridinyl]piperidin-4-amine
CID 118054993
5-[6-[3-[2-(trifluoromethyl)-4-pyridinyl]cyclobutyl]oxypyridin-1-ium-3-yl]-1,2-oxazol-3-one chloride
CID 139450930
1-chloro-4-(trifluoromethyl)benzene;1-[2-(trifluoromethyl)-4-pyridinyl]-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]thiazol-3-one
CID 145232901
4-cyclopropyl-2-iodo-1-(trifluoromethyl)benzene
CID 130067640
2,6-bis(trifluoromethyl)-4-[4-[2-(trifluoromethyl)-4-pyridinyl]-1,5-dioxocan-2-yl]benzonitrile
CID 172578659

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-2-(trifluoromethyl)pyridine?
The IUPAC name of 4-cyclopropyl-2-(trifluoromethyl)pyridine (CID 143990430) is 4-cyclopropyl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 4-cyclopropyl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 4-cyclopropyl-2-(trifluoromethyl)pyridine is FC(F)(F)c1cc(C2CC2)ccn1.
What is the InChIKey of 4-cyclopropyl-2-(trifluoromethyl)pyridine?
The InChIKey is JKJVZUPSHBEHMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N/c10-9(11,12)8-5-7(3-4-13-8)6-1-2-6/h3-6H,1-2H2.
What are the key properties of 4-cyclopropyl-2-(trifluoromethyl)pyridine?
4-cyclopropyl-2-(trifluoromethyl)pyridine has a molecular weight of 187.16 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 143990430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).