2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine

C14H20FN — CID 106881701

IUPAC2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine
SMILESCCC1(c2c(C)cc(C)cc2F)CCCN1
InChIInChI=1S/C14H20FN/c1-4-14(6-5-7-16-14)13-11(3)8-10(2)9-12(13)15/h8-9,16H,4-7H2,1-3H3
InChIKeyYSLNIRYUEKWCQI-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.43
Rot. Bonds2

About 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine

2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine (PubChem CID 106881701) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine.

Molecular Properties

Compound Name2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine
PubChem CID106881701
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine
SMILESCCC1(c2c(C)cc(C)cc2F)CCCN1
InChIInChI=1S/C14H20FN/c1-4-14(6-5-7-16-14)13-11(3)8-10(2)9-12(13)15/h8-9,16H,4-7H2,1-3H3
InChIKeyYSLNIRYUEKWCQI-UHFFFAOYSA-N
XLogP3.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-2-(4-fluoro-3-methylphenyl)pyrrolidine
CID 66465325
2-ethyl-2-(3-fluoro-5-methylphenyl)azepane
CID 79704729
2-(5-bromo-2-fluorophenyl)-2-ethylpyrrolidine
CID 79743122
1-(2-fluoro-4,6-dimethylphenyl)cyclopropan-1-amine
CID 84767931
4-(2-ethylpyrrolidin-2-yl)-3-fluoropyridine
CID 104738401
2-(2,4-dimethylphenyl)-2-propylpyrrolidine
CID 66466694
5-(2-ethylpyrrolidin-2-yl)pyrimidine
CID 66466456
3-(2-ethylpyrrolidin-2-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine
CID 83070962
5-bromo-2-(2-ethylpyrrolidin-2-yl)-6-fluoro-1H-benzimidazole
CID 83070190
2-(1-ethylcyclopropyl)-1,5-difluoro-3-methylbenzene
CID 176962607
2-ethyl-2-(4-ethylphenyl)pyrrolidine
CID 66467145
3-(2-ethylpyrrolidin-2-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 83071114

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine?
The IUPAC name of 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine (CID 106881701) is 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine.
What is the SMILES notation for 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine?
The canonical SMILES for 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine is CCC1(c2c(C)cc(C)cc2F)CCCN1.
What is the InChIKey of 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine?
The InChIKey is YSLNIRYUEKWCQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-4-14(6-5-7-16-14)13-11(3)8-10(2)9-12(13)15/h8-9,16H,4-7H2,1-3H3.
What are the key properties of 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine?
2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine has a molecular weight of 221.32 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(2-fluoro-4,6-dimethylphenyl)pyrrolidine is sourced from PubChem (CID 106881701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).