2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine

C17H28N2S — CID 62346451

IUPAC2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine
SMILESCCc1ccc(C(CN)N2CCCC2C2CCCC2)s1
InChIInChI=1S/C17H28N2S/c1-2-14-9-10-17(20-14)16(12-18)19-11-5-8-15(19)13-6-3-4-7-13/h9-10,13,15-16H,2-8,11-12,18H2,1H3
InChIKeyLQPWACGFZYIZNH-UHFFFAOYSA-N
MW292.49 g/mol
LogP3.96
Rot. Bonds5

About 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine

2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine (PubChem CID 62346451) has the molecular formula C17H28N2S and a molecular weight of 292.49 g/mol. Its IUPAC name is 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine
PubChem CID62346451
Molecular FormulaC17H28N2S
Molecular Weight292.49 g/mol
Exact Mass292.20
IUPAC Name2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine
SMILESCCc1ccc(C(CN)N2CCCC2C2CCCC2)s1
InChIInChI=1S/C17H28N2S/c1-2-14-9-10-17(20-14)16(12-18)19-11-5-8-15(19)13-6-3-4-7-13/h9-10,13,15-16H,2-8,11-12,18H2,1H3
InChIKeyLQPWACGFZYIZNH-UHFFFAOYSA-N
XLogP3.96
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.49
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine?
The IUPAC name of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine (CID 62346451) is 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine.
What is the SMILES notation for 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine?
The canonical SMILES for 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine is CCc1ccc(C(CN)N2CCCC2C2CCCC2)s1.
What is the InChIKey of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine?
The InChIKey is LQPWACGFZYIZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2S/c1-2-14-9-10-17(20-14)16(12-18)19-11-5-8-15(19)13-6-3-4-7-13/h9-10,13,15-16H,2-8,11-12,18H2,1H3.
What are the key properties of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine?
2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine has a molecular weight of 292.49 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentylpyrrolidin-1-yl)-2-(5-ethylthiophen-2-yl)ethanamine is sourced from PubChem (CID 62346451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).