2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine

C14H24N2O — CID 55050220

IUPAC2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
SMILESCCCC1CCN(C(CN)c2ccco2)CC1
InChIInChI=1S/C14H24N2O/c1-2-4-12-6-8-16(9-7-12)13(11-15)14-5-3-10-17-14/h3,5,10,12-13H,2,4,6-9,11,15H2,1H3
InChIKeyQETNKPOBFFQGQK-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.79
Rot. Bonds5

About 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine

2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine (PubChem CID 55050220) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
PubChem CID55050220
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
SMILESCCCC1CCN(C(CN)c2ccco2)CC1
InChIInChI=1S/C14H24N2O/c1-2-4-12-6-8-16(9-7-12)13(11-15)14-5-3-10-17-14/h3,5,10,12-13H,2,4,6-9,11,15H2,1H3
InChIKeyQETNKPOBFFQGQK-UHFFFAOYSA-N
XLogP2.79
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine (CID 55050220) is 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine is CCCC1CCN(C(CN)c2ccco2)CC1.
What is the InChIKey of 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine?
The InChIKey is QETNKPOBFFQGQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-2-4-12-6-8-16(9-7-12)13(11-15)14-5-3-10-17-14/h3,5,10,12-13H,2,4,6-9,11,15H2,1H3.
What are the key properties of 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine?
2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 55050220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).