2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine

C14H22N2 — CID 63784557

IUPAC2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine
SMILESCCC1CCCN1c1ccccc1CCN
InChIInChI=1S/C14H22N2/c1-2-13-7-5-11-16(13)14-8-4-3-6-12(14)9-10-15/h3-4,6,8,13H,2,5,7,9-11,15H2,1H3
InChIKeyZETAXAFMLMKQTO-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.57
Rot. Bonds4

About 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine

2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine (PubChem CID 63784557) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine
PubChem CID63784557
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine
SMILESCCC1CCCN1c1ccccc1CCN
InChIInChI=1S/C14H22N2/c1-2-13-7-5-11-16(13)14-8-4-3-6-12(14)9-10-15/h3-4,6,8,13H,2,5,7,9-11,15H2,1H3
InChIKeyZETAXAFMLMKQTO-UHFFFAOYSA-N
XLogP2.57
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2-ethylazepan-1-yl)phenyl]methanamine
CID 104688934
[2-(2-ethylpyrrolidin-1-yl)phenyl]methanol
CID 60973877
2-[2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)phenyl]ethanamine
CID 65322647
2-(2-ethylpyrrolidin-1-yl)benzaldehyde
CID 60973642
[1-[2-(aminomethyl)phenyl]pyrrolidin-2-yl]methanol
CID 61407421
(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]propan-1-amine
CID 103958582
N-[[2-(2-ethylazepan-1-yl)phenyl]methyl]propan-2-amine
CID 104690764
[2-(2-ethylpyrrolidin-1-yl)-3-methylphenyl]methanamine
CID 107105560
2-[1-(2-ethylphenyl)pyrrolidin-2-yl]ethanol
CID 117028523
(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
CID 78939880
(1S)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
CID 63370962
[(2S)-1-(2-fluorophenyl)pyrrolidin-2-yl]methanamine
CID 130691324

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine?
The IUPAC name of 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine (CID 63784557) is 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine?
The canonical SMILES for 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine is CCC1CCCN1c1ccccc1CCN.
What is the InChIKey of 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine?
The InChIKey is ZETAXAFMLMKQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-2-13-7-5-11-16(13)14-8-4-3-6-12(14)9-10-15/h3-4,6,8,13H,2,5,7,9-11,15H2,1H3.
What are the key properties of 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine?
2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine is sourced from PubChem (CID 63784557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).