1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine

C15H30N2 — CID 104747000

IUPAC1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine
SMILESCCNC(CN1CCC(CC)C1)C1CCCC1
InChIInChI=1S/C15H30N2/c1-3-13-9-10-17(11-13)12-15(16-4-2)14-7-5-6-8-14/h13-16H,3-12H2,1-2H3
InChIKeyBTOBWRAOYBFTJS-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.89
Rot. Bonds6

About 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine

1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine (PubChem CID 104747000) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine
PubChem CID104747000
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine
SMILESCCNC(CN1CCC(CC)C1)C1CCCC1
InChIInChI=1S/C15H30N2/c1-3-13-9-10-17(11-13)12-15(16-4-2)14-7-5-6-8-14/h13-16H,3-12H2,1-2H3
InChIKeyBTOBWRAOYBFTJS-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine?
The IUPAC name of 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine (CID 104747000) is 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine is CCNC(CN1CCC(CC)C1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine?
The InChIKey is BTOBWRAOYBFTJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-13-9-10-17(11-13)12-15(16-4-2)14-7-5-6-8-14/h13-16H,3-12H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine?
1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine has a molecular weight of 238.42 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine is sourced from PubChem (CID 104747000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).