2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine

C13H22N2O — CID 43584299

IUPAC2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
SMILESCCC1CCCN(C(CN)c2ccco2)C1
InChIInChI=1S/C13H22N2O/c1-2-11-5-3-7-15(10-11)12(9-14)13-6-4-8-16-13/h4,6,8,11-12H,2-3,5,7,9-10,14H2,1H3
InChIKeyYLWIYTCNICFIEA-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.40
Rot. Bonds4

About 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine

2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine (PubChem CID 43584299) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
PubChem CID43584299
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
SMILESCCC1CCCN(C(CN)c2ccco2)C1
InChIInChI=1S/C13H22N2O/c1-2-11-5-3-7-15(10-11)12(9-14)13-6-4-8-16-13/h4,6,8,11-12H,2-3,5,7,9-10,14H2,1H3
InChIKeyYLWIYTCNICFIEA-UHFFFAOYSA-N
XLogP2.40
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[2-amino-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanol
CID 112624466
2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
CID 55050220
2-(furan-2-yl)-2-(3-methoxypyrrolidin-1-yl)ethanamine
CID 103530810
2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine
CID 113416920
1-[2-amino-1-(furan-2-yl)ethyl]-4-methylpiperidin-3-ol
CID 102956003
2-(3-ethylpiperidin-1-yl)-2-(3-methylphenyl)ethanamine
CID 43584386
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(furan-2-yl)ethanamine
CID 79931766
2-(4-ethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
CID 43584286
2-(3-ethylpiperidin-1-yl)-2-(4-methoxyphenyl)ethanamine
CID 43584268
2-(1,3-benzodioxol-5-yl)-2-(3-ethylpiperidin-1-yl)ethanamine
CID 43584359
1-[2-amino-1-(furan-2-yl)ethyl]azetidin-3-ol
CID 131207499
2-(2,3-dimethoxyphenyl)-2-(3-ethylpiperidin-1-yl)ethanamine
CID 43584302

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
The IUPAC name of 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine (CID 43584299) is 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine is CCC1CCCN(C(CN)c2ccco2)C1.
What is the InChIKey of 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
The InChIKey is YLWIYTCNICFIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-2-11-5-3-7-15(10-11)12(9-14)13-6-4-8-16-13/h4,6,8,11-12H,2-3,5,7,9-10,14H2,1H3.
What are the key properties of 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine has a molecular weight of 222.33 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 43584299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).