2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine

C16H28N2O — CID 103494690

IUPAC2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
SMILESCCc1ccc(C(CN)N2CCC(C(C)C)CC2)o1
InChIInChI=1S/C16H28N2O/c1-4-14-5-6-16(19-14)15(11-17)18-9-7-13(8-10-18)12(2)3/h5-6,12-13,15H,4,7-11,17H2,1-3H3
InChIKeyBCCPOSIOQVEPCH-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.21
Rot. Bonds5

About 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine

2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine (PubChem CID 103494690) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
PubChem CID103494690
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
SMILESCCc1ccc(C(CN)N2CCC(C(C)C)CC2)o1
InChIInChI=1S/C16H28N2O/c1-4-14-5-6-16(19-14)15(11-17)18-9-7-13(8-10-18)12(2)3/h5-6,12-13,15H,4,7-11,17H2,1-3H3
InChIKeyBCCPOSIOQVEPCH-UHFFFAOYSA-N
XLogP3.21
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine (CID 103494690) is 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine is CCc1ccc(C(CN)N2CCC(C(C)C)CC2)o1.
What is the InChIKey of 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine?
The InChIKey is BCCPOSIOQVEPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-4-14-5-6-16(19-14)15(11-17)18-9-7-13(8-10-18)12(2)3/h5-6,12-13,15H,4,7-11,17H2,1-3H3.
What are the key properties of 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine?
2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine has a molecular weight of 264.41 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 103494690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).