5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine

C11H15FN2 — CID 135135528

IUPAC5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine
SMILESCc1cc(F)cnc1CC1CCNC1
InChIInChI=1S/C11H15FN2/c1-8-4-10(12)7-14-11(8)5-9-2-3-13-6-9/h4,7,9,13H,2-3,5-6H2,1H3
InChIKeyZYDGJPICLFBBGH-UHFFFAOYSA-N
MW194.25 g/mol
LogP1.68
Rot. Bonds2

About 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine

5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine (PubChem CID 135135528) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine.

Molecular Properties

Compound Name5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine
PubChem CID135135528
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine
SMILESCc1cc(F)cnc1CC1CCNC1
InChIInChI=1S/C11H15FN2/c1-8-4-10(12)7-14-11(8)5-9-2-3-13-6-9/h4,7,9,13H,2-3,5-6H2,1H3
InChIKeyZYDGJPICLFBBGH-UHFFFAOYSA-N
XLogP1.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-difluoro-2-(piperidin-4-ylmethyl)pyridine
CID 170068814
5-fluoro-2-(pyrrolidin-3-ylmethyl)pyrimidine;hydrochloride
CID 139490791
2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine
CID 135135099
5-methyl-4-(pyrrolidin-3-ylmethyl)-1,3-thiazole
CID 105440268
2-methyl-5-[[(3S)-pyrrolidin-3-yl]methyl]pyrazine
CID 157065422
(3R)-3-[(4-fluorophenyl)methyl]pyrrolidine
CID 86309434
1,7-dimethyl-3-(pyrrolidin-3-ylmethyl)indazole
CID 84692879
2,3-dimethyl-5-(pyrrolidin-3-ylmethyl)pyrazine
CID 135135159
3-[(3-bromo-4-fluoro-5-methylphenyl)methyl]pyrrolidine
CID 84809637
6-fluoro-2-(pyrrolidin-3-ylmethyl)quinazoline
CID 105489460
3-[(3-methyl-2-pyridinyl)methyl]azepane
CID 104680698
3-[(4-fluoro-5-methoxy-2-methylphenyl)methyl]pyrrolidine
CID 84789080

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine?
The IUPAC name of 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine (CID 135135528) is 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine.
What is the SMILES notation for 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine?
The canonical SMILES for 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine is Cc1cc(F)cnc1CC1CCNC1.
What is the InChIKey of 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine?
The InChIKey is ZYDGJPICLFBBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c1-8-4-10(12)7-14-11(8)5-9-2-3-13-6-9/h4,7,9,13H,2-3,5-6H2,1H3.
What are the key properties of 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine?
5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine has a molecular weight of 194.25 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-methyl-2-(pyrrolidin-3-ylmethyl)pyridine is sourced from PubChem (CID 135135528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).