2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine

C14H21FN2 — CID 114058265

IUPAC2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine
SMILESCCC1CCCN1CC(N)c1ccccc1F
InChIInChI=1S/C14H21FN2/c1-2-11-6-5-9-17(11)10-14(16)12-7-3-4-8-13(12)15/h3-4,7-8,11,14H,2,5-6,9-10,16H2,1H3
InChIKeyXZWICFZYOLCRDR-UHFFFAOYSA-N
MW236.33 g/mol
LogP2.70
Rot. Bonds4

About 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine

2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine (PubChem CID 114058265) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine
PubChem CID114058265
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC Name2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine
SMILESCCC1CCCN1CC(N)c1ccccc1F
InChIInChI=1S/C14H21FN2/c1-2-11-6-5-9-17(11)10-14(16)12-7-3-4-8-13(12)15/h3-4,7-8,11,14H,2,5-6,9-10,16H2,1H3
InChIKeyXZWICFZYOLCRDR-UHFFFAOYSA-N
XLogP2.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-difluorophenyl)-2-(2-ethylpyrrolidin-1-yl)ethanamine
CID 107519852
1-(2-ethoxyphenyl)-2-(2-ethylpyrrolidin-1-yl)ethanamine
CID 54882989
2-(2-ethylpyrrolidin-1-yl)-1-(4-fluorophenyl)ethanamine
CID 107519853
(2R)-1-(2-ethylpyrrolidin-1-yl)-3-phenylpropan-2-amine
CID 112736480
1-(2-fluorophenyl)-3-(2-methylpyrrolidin-1-yl)propan-1-amine
CID 62643379
2-(2-ethylpyrrolidin-1-yl)-2-(2-fluorophenyl)ethanamine
CID 60974674
1-(2-ethylpiperidin-1-yl)-1-(2-fluorophenyl)propan-2-amine
CID 55018825
1-(2-fluorophenyl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine
CID 114058299
2-(2-ethylpiperidin-1-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43266464
1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine
CID 43266458
1-(2-ethylazepan-1-yl)-1-(2-fluorophenyl)butan-2-amine
CID 104688989
2-ethyl-1-(2-fluoropropyl)pyrrolidine
CID 177053751

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine (CID 114058265) is 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine is CCC1CCCN1CC(N)c1ccccc1F.
What is the InChIKey of 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine?
The InChIKey is XZWICFZYOLCRDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-2-11-6-5-9-17(11)10-14(16)12-7-3-4-8-13(12)15/h3-4,7-8,11,14H,2,5-6,9-10,16H2,1H3.
What are the key properties of 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine?
2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine has a molecular weight of 236.33 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine is sourced from PubChem (CID 114058265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).