2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine

C10H10F4N2O — CID 103536626

IUPAC2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine
SMILESCOC1CCN(c2c(F)c(F)nc(F)c2F)C1
InChIInChI=1S/C10H10F4N2O/c1-17-5-2-3-16(4-5)8-6(11)9(13)15-10(14)7(8)12/h5H,2-4H2,1H3
InChIKeyOJILSSXUMKZYJF-UHFFFAOYSA-N
MW250.19 g/mol
LogP1.86
Rot. Bonds2

About 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine

2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine (PubChem CID 103536626) has the molecular formula C10H10F4N2O and a molecular weight of 250.19 g/mol. Its IUPAC name is 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine.

Molecular Properties

Compound Name2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine
PubChem CID103536626
Molecular FormulaC10H10F4N2O
Molecular Weight250.19 g/mol
Exact Mass250.07
IUPAC Name2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine
SMILESCOC1CCN(c2c(F)c(F)nc(F)c2F)C1
InChIInChI=1S/C10H10F4N2O/c1-17-5-2-3-16(4-5)8-6(11)9(13)15-10(14)7(8)12/h5H,2-4H2,1H3
InChIKeyOJILSSXUMKZYJF-UHFFFAOYSA-N
XLogP1.86
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.19
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3,5-difluoro-4-(3-methoxypyrrolidin-1-yl)benzenecarbothioamide
CID 103533656
ethyl 1-(2,3,5,6-tetrafluoro-4-pyridinyl)piperidine-4-carboxylate
CID 57457177
2,3,5,6-tetrafluoro-4-(3-pyrrolidin-1-ylpiperidin-1-yl)pyridine
CID 133338783
2,3,5,6-tetrafluoro-4-[4-(2-phenylethoxy)piperidin-1-yl]pyridine
CID 133371798
1-(3-chloro-2-fluorophenyl)-3-methoxypyrrolidine
CID 90124088
1-[6-amino-2,4-difluoro-3-[(3S)-3-methoxypyrrolidin-1-yl]phenyl]ethanone
CID 164916725
1-(2,3,5,6-tetrafluoro-4-pyridinyl)azetidin-3-ol
CID 130964229
2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole
CID 130719650
3-fluoro-4-(3-methoxypyrrolidin-1-yl)-2-phenylpyridine
CID 91558572
[2,3-difluoro-4-(3-methoxypyrrolidin-1-yl)phenyl]methanamine
CID 107933093
N-[1-(2,3,5,6-tetrafluoro-4-pyridinyl)piperidin-3-yl]methanesulfonamide
CID 133371214
4-chloro-6-(3-methoxypyrrolidin-1-yl)-2-methylpyrimidine
CID 108773094

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine?
The IUPAC name of 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine (CID 103536626) is 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine.
What is the SMILES notation for 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine?
The canonical SMILES for 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine is COC1CCN(c2c(F)c(F)nc(F)c2F)C1.
What is the InChIKey of 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine?
The InChIKey is OJILSSXUMKZYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F4N2O/c1-17-5-2-3-16(4-5)8-6(11)9(13)15-10(14)7(8)12/h5H,2-4H2,1H3.
What are the key properties of 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine?
2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine has a molecular weight of 250.19 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine is sourced from PubChem (CID 103536626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).