3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine

C12H17FN2 — CID 129252823

IUPAC3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine
SMILESCCN1CCCC1c1cc(F)cnc1C
InChIInChI=1S/C12H17FN2/c1-3-15-6-4-5-12(15)11-7-10(13)8-14-9(11)2/h7-8,12H,3-6H2,1-2H3
InChIKeyZCYCVWYMOUGQEE-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.69
Rot. Bonds2

About 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine

3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine (PubChem CID 129252823) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine.

Molecular Properties

Compound Name3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine
PubChem CID129252823
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine
SMILESCCN1CCCC1c1cc(F)cnc1C
InChIInChI=1S/C12H17FN2/c1-3-15-6-4-5-12(15)11-7-10(13)8-14-9(11)2/h7-8,12H,3-6H2,1-2H3
InChIKeyZCYCVWYMOUGQEE-UHFFFAOYSA-N
XLogP2.69
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 86664567
5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine
CID 102543179
N-[(1-ethylpyrrolidin-2-yl)methyl]-5-fluoropyridin-2-amine
CID 61312935
5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-propan-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67502090
2-chloro-5-fluoro-3-(1-propan-2-ylpyrrolidin-2-yl)pyridine
CID 129075345
5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-(2-hydroxypropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67501570
2-(2-chloro-5-fluoro-3-pyridinyl)pyrrolidine-1-carboxylic acid
CID 146196818
5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-(1-methylcyclopropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67500247
5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-(1-methylcyclopropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67500249
4-[1-[5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]ethenylamino]cyclohexan-1-ol
CID 129075357
[2-(1-ethylpyrrolidin-2-yl)-1,3-oxazol-5-yl]methanamine
CID 115085726
5-(1-ethylpyrrolidin-2-yl)-1H-pyrazole-3-carbaldehyde
CID 115092571

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine?
The IUPAC name of 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine (CID 129252823) is 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine.
What is the SMILES notation for 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine?
The canonical SMILES for 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine is CCN1CCCC1c1cc(F)cnc1C.
What is the InChIKey of 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine?
The InChIKey is ZCYCVWYMOUGQEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-3-15-6-4-5-12(15)11-7-10(13)8-14-9(11)2/h7-8,12H,3-6H2,1-2H3.
What are the key properties of 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine?
3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine has a molecular weight of 208.28 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine is sourced from PubChem (CID 129252823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).