3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine

C14H20FN — CID 83910621

IUPAC3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine
SMILESCC(C)C(c1ccccc1F)C1CCNC1
InChIInChI=1S/C14H20FN/c1-10(2)14(11-7-8-16-9-11)12-5-3-4-6-13(12)15/h3-6,10-11,14,16H,7-9H2,1-2H3
InChIKeyDAQTXVZTGGVCQY-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.17
Rot. Bonds3

About 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine

3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine (PubChem CID 83910621) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine.

Molecular Properties

Compound Name3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine
PubChem CID83910621
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine
SMILESCC(C)C(c1ccccc1F)C1CCNC1
InChIInChI=1S/C14H20FN/c1-10(2)14(11-7-8-16-9-11)12-5-3-4-6-13(12)15/h3-6,10-11,14,16H,7-9H2,1-2H3
InChIKeyDAQTXVZTGGVCQY-UHFFFAOYSA-N
XLogP3.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[1-(2-fluorophenyl)-2-methylpropyl]oxane
CID 90383596
2-[1-(2-fluorophenyl)ethyl]piperazine
CID 173119737
4-(2-methyl-1-pyrrolidin-3-ylpropyl)pyridine
CID 83908704
3-[1-fluoro-2-(2-fluorophenyl)ethyl]pyrrolidine
CID 105464966
3-(2-methyl-1-pyrrolidin-3-ylpropyl)pyridine
CID 83908706
1-(1-cyclopropylethyl)-2-fluorobenzene
CID 126566249
N-[1-(2-fluorophenyl)ethyl]-N-methylpyrrolidine-3-sulfonamide
CID 65416386
1-(2-fluorophenyl)-N-methyl-2-pyrrolidin-3-ylethanamine
CID 116951614
3-[1-(2-fluorophenyl)propyl]piperidine;sulfuryl dichloride
CID 174919101
N-[1-(2-fluorophenyl)ethyl]azepan-4-amine
CID 103981604
3-(2-fluorophenyl)-4-propan-2-ylpiperidine
CID 79455121
N-[1-(2,3-difluorophenyl)ethyl]-N-methylpyrrolidin-3-amine
CID 114059322

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine?
The IUPAC name of 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine (CID 83910621) is 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine.
What is the SMILES notation for 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine?
The canonical SMILES for 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine is CC(C)C(c1ccccc1F)C1CCNC1.
What is the InChIKey of 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine?
The InChIKey is DAQTXVZTGGVCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-10(2)14(11-7-8-16-9-11)12-5-3-4-6-13(12)15/h3-6,10-11,14,16H,7-9H2,1-2H3.
What are the key properties of 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine?
3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine has a molecular weight of 221.32 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-fluorophenyl)-2-methylpropyl]pyrrolidine is sourced from PubChem (CID 83910621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).