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

C18H24N2O — CID 43346331

IUPAC2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
SMILESNCC(c1ccco1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C18H24N2O/c19-14-17(18-7-4-12-21-18)20-10-8-16(9-11-20)13-15-5-2-1-3-6-15/h1-7,12,16-17H,8-11,13-14,19H2
InChIKeyQEZKPDALQIXMDH-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.23
Rot. Bonds5

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

2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine (PubChem CID 43346331) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
PubChem CID43346331
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
SMILESNCC(c1ccco1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C18H24N2O/c19-14-17(18-7-4-12-21-18)20-10-8-16(9-11-20)13-15-5-2-1-3-6-15/h1-7,12,16-17H,8-11,13-14,19H2
InChIKeyQEZKPDALQIXMDH-UHFFFAOYSA-N
XLogP3.23
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
CID 55050220
[1-[2-amino-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanol
CID 112624466
2-(4-benzylpiperidin-1-yl)propan-1-amine
CID 16642433
2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol
CID 82696071
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
4-benzyl-1-propan-2-ylpiperidine
CID 22959492
1-[2-amino-1-(furan-2-yl)ethyl]azetidin-3-ol
CID 131207499
3-benzyl-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-N'-methylpyrrolidine-1-carboximidamide
CID 111724655
2-(4-benzylpiperidin-1-yl)pentan-3-amine
CID 43346352
2-[4-(2-fluorophenyl)piperazin-1-yl]-2-(furan-2-yl)ethanamine
CID 45496819
2-(4-benzylpiperidin-1-yl)-N-[(1S)-1-(furan-2-yl)ethyl]acetamide
CID 9430556

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
The IUPAC name of 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine (CID 43346331) is 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine is NCC(c1ccco1)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
The InChIKey is QEZKPDALQIXMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c19-14-17(18-7-4-12-21-18)20-10-8-16(9-11-20)13-15-5-2-1-3-6-15/h1-7,12,16-17H,8-11,13-14,19H2.
What are the key properties of 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine?
2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine has a molecular weight of 284.40 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 43346331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).