(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine

C12H16FN — CID 124671045

IUPAC(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine
SMILESCC1(C)CNC[C@H]1c1ccccc1F
InChIInChI=1S/C12H16FN/c1-12(2)8-14-7-10(12)9-5-3-4-6-11(9)13/h3-6,10,14H,7-8H2,1-2H3/t10-/m0/s1
InChIKeyFLZGNBLMORKILV-JTQLQIEISA-N
MW193.27 g/mol
LogP2.54
Rot. Bonds1

About (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine

(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine (PubChem CID 124671045) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine.

Molecular Properties

Compound Name(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine
PubChem CID124671045
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine
SMILESCC1(C)CNC[C@H]1c1ccccc1F
InChIInChI=1S/C12H16FN/c1-12(2)8-14-7-10(12)9-5-3-4-6-11(9)13/h3-6,10,14H,7-8H2,1-2H3/t10-/m0/s1
InChIKeyFLZGNBLMORKILV-JTQLQIEISA-N
XLogP2.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4R)-4-(2-methoxyphenyl)-3,3-dimethylpyrrolidine
CID 129411572
2-(2-fluorophenyl)-5,5-dimethyl-1,3-dioxane
CID 174359153
5-(2-fluorophenyl)-2-propan-2-yl-7-azaspiro[3.5]nonane
CID 103565654
3-(2-fluorophenyl)-4-methyl-4-(4,4,4-trifluorobutyl)piperidine
CID 116536422
3-(2-fluorophenyl)-2,2-dimethylcyclobutan-1-ol
CID 81415603
5-(2-fluorophenyl)-9-methyl-3-azaspiro[5.6]dodecane
CID 79454886
2-(2-fluorophenyl)-1-methylcyclopropane-1-carboxylic acid
CID 82112065
(3R,4R)-3-(fluoromethyl)-4-(2-fluorophenyl)pyrrolidine
CID 129492988
6-(2-fluorophenyl)-2,3-dimethyl-2,8-diazaspiro[4.5]decane
CID 81468166
2-(2-bromophenyl)-6,6-dimethyl-1,4-oxazepane
CID 115362109
3,3-dimethyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine
CID 121207524
(2S)-2-(2-fluorophenyl)-1-methylpiperazine
CID 28804930

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine?
The IUPAC name of (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine (CID 124671045) is (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine.
What is the SMILES notation for (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine?
The canonical SMILES for (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine is CC1(C)CNC[C@H]1c1ccccc1F.
What is the InChIKey of (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine?
The InChIKey is FLZGNBLMORKILV-JTQLQIEISA-N. The full InChI is InChI=1S/C12H16FN/c1-12(2)8-14-7-10(12)9-5-3-4-6-11(9)13/h3-6,10,14H,7-8H2,1-2H3/t10-/m0/s1.
What are the key properties of (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine?
(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine has a molecular weight of 193.27 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine is sourced from PubChem (CID 124671045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).