2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine

C10H13FN2 — CID 138636032

IUPAC2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine
SMILESCc1cc(F)nc(C2CCNC2)c1
InChIInChI=1S/C10H13FN2/c1-7-4-9(13-10(11)5-7)8-2-3-12-6-8/h4-5,8,12H,2-3,6H2,1H3
InChIKeyBPJQCWCJVFADIB-UHFFFAOYSA-N
MW180.23 g/mol
LogP1.61
Rot. Bonds1

About 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine

2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine (PubChem CID 138636032) has the molecular formula C10H13FN2 and a molecular weight of 180.23 g/mol. Its IUPAC name is 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine.

Molecular Properties

Compound Name2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine
PubChem CID138636032
Molecular FormulaC10H13FN2
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Name2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine
SMILESCc1cc(F)nc(C2CCNC2)c1
InChIInChI=1S/C10H13FN2/c1-7-4-9(13-10(11)5-7)8-2-3-12-6-8/h4-5,8,12H,2-3,6H2,1H3
InChIKeyBPJQCWCJVFADIB-UHFFFAOYSA-N
XLogP1.61
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride
CID 138636031
ethane;4-methyl-2-pyrrolidin-3-ylpyridine
CID 143900241
3-(3-fluoro-2,5-dimethylphenyl)pyrrolidine
CID 84772855
3-(3-chloro-2-fluoro-5-methylphenyl)pyrrolidine
CID 84680018
3-(2-fluoro-3,6-dimethylphenyl)pyrrolidine
CID 84772859
2-(dimethylamino)-4-[(3S)-pyrrolidin-3-yl]-1H-pyrimidin-6-one
CID 136848975
(2-methyl-6-pyrrolidin-3-yl-4-pyridinyl) trifluoromethanesulfonate
CID 121271044
7-fluoro-2-pyrrolidin-3-ylquinoline-4-carboxylic acid
CID 84638041
2,4-di(pyrrolidin-3-yl)-1,3-thiazole
CID 115034162
2-bromo-4-pyrrolidin-3-yl-1,3-thiazole
CID 115039273
2-methyl-N-pyrimidin-2-yl-6-pyrrolidin-3-ylpyrimidin-4-amine
CID 110095196
2-chloro-3-methyl-5-pyrrolidin-3-ylpyrazine
CID 83831453

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine?
The IUPAC name of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine (CID 138636032) is 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine.
What is the SMILES notation for 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine?
The canonical SMILES for 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine is Cc1cc(F)nc(C2CCNC2)c1.
What is the InChIKey of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine?
The InChIKey is BPJQCWCJVFADIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c1-7-4-9(13-10(11)5-7)8-2-3-12-6-8/h4-5,8,12H,2-3,6H2,1H3.
What are the key properties of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine?
2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine has a molecular weight of 180.23 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine is sourced from PubChem (CID 138636032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).