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

C10H14ClFN2 — CID 138636031

IUPAC2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride
SMILESCc1cc(F)nc(C2CCNC2)c1.Cl
InChIInChI=1S/C10H13FN2.ClH/c1-7-4-9(13-10(11)5-7)8-2-3-12-6-8;/h4-5,8,12H,2-3,6H2,1H3;1H
InChIKeyQHNRJNGIUOVYBC-UHFFFAOYSA-N
MW216.69 g/mol
LogP2.03
Rot. Bonds1

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

2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride (PubChem CID 138636031) has the molecular formula C10H14ClFN2 and a molecular weight of 216.69 g/mol. Its IUPAC name is 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride.

Molecular Properties

Compound Name2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride
PubChem CID138636031
Molecular FormulaC10H14ClFN2
Molecular Weight216.69 g/mol
Exact Mass216.08
IUPAC Name2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride
SMILESCc1cc(F)nc(C2CCNC2)c1.Cl
InChIInChI=1S/C10H13FN2.ClH/c1-7-4-9(13-10(11)5-7)8-2-3-12-6-8;/h4-5,8,12H,2-3,6H2,1H3;1H
InChIKeyQHNRJNGIUOVYBC-UHFFFAOYSA-N
XLogP2.03
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.69
LogP ≤ 52.03
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
CID 138636032
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
4-pyrrolidin-3-yl-1,3-thiazol-2-amine;dihydrochloride
CID 171340444
2-(dimethylamino)-4-[(3S)-pyrrolidin-3-yl]-1H-pyrimidin-6-one
CID 136848975
3-(5-fluoro-2-methylphenyl)pyrrolidine;hydrochloride
CID 169498179
(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

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride?
The IUPAC name of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride (CID 138636031) is 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride.
What is the SMILES notation for 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride?
The canonical SMILES for 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride is Cc1cc(F)nc(C2CCNC2)c1.Cl.
What is the InChIKey of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride?
The InChIKey is QHNRJNGIUOVYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2.ClH/c1-7-4-9(13-10(11)5-7)8-2-3-12-6-8;/h4-5,8,12H,2-3,6H2,1H3;1H.
What are the key properties of 2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride?
2-fluoro-4-methyl-6-pyrrolidin-3-ylpyridine;hydrochloride has a molecular weight of 216.69 g/mol, XLogP of 2.03, 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;hydrochloride is sourced from PubChem (CID 138636031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).