1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine

C17H24N2O — CID 43266458

IUPAC1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine
SMILESCCC1CCCCN1CC(N)c1cc2ccccc2o1
InChIInChI=1S/C17H24N2O/c1-2-14-8-5-6-10-19(14)12-15(18)17-11-13-7-3-4-9-16(13)20-17/h3-4,7,9,11,14-15H,2,5-6,8,10,12,18H2,1H3
InChIKeyCABGUESDMDIAKQ-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.70
Rot. Bonds4

About 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine

1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine (PubChem CID 43266458) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine
PubChem CID43266458
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine
SMILESCCC1CCCCN1CC(N)c1cc2ccccc2o1
InChIInChI=1S/C17H24N2O/c1-2-14-8-5-6-10-19(14)12-15(18)17-11-13-7-3-4-9-16(13)20-17/h3-4,7,9,11,14-15H,2,5-6,8,10,12,18H2,1H3
InChIKeyCABGUESDMDIAKQ-UHFFFAOYSA-N
XLogP3.70
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-benzofuran-2-yl)-2-(2,3-dimethylpiperidin-1-yl)ethanol
CID 62123428
1-(1-benzofuran-2-yl)-2-(4,4-dimethylpiperidin-1-yl)ethanamine
CID 62935690
2-(2-ethylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanamine
CID 114058265
1-(1-benzofuran-2-yl)-N'-cyclopentyl-N'-ethylethane-1,2-diamine
CID 43541045
1-(1-benzofuran-2-yl)-2-(3,4,5-trimethylpiperazin-1-yl)ethanamine
CID 114537689
1-(2-ethoxyphenyl)-2-(2-ethylpyrrolidin-1-yl)ethanamine
CID 54882989
1-[1-[1-(1-benzofuran-2-yl)ethyl]piperidin-2-yl]ethanamine
CID 63254702
(2R)-1-(2-ethylpyrrolidin-1-yl)-3-phenylpropan-2-amine
CID 112736480
1-(2-chloro-2-phenylethyl)-2-ethylpiperidine
CID 82214216
3-(2-ethylazepan-1-yl)-1-phenylpropan-1-amine
CID 104690312
2-(2-ethylpiperidin-1-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43266464
2-(2-ethylpyrrolidin-1-yl)-1-(4-fluorophenyl)ethanamine
CID 107519853

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine (CID 43266458) is 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine is CCC1CCCCN1CC(N)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine?
The InChIKey is CABGUESDMDIAKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-14-8-5-6-10-19(14)12-15(18)17-11-13-7-3-4-9-16(13)20-17/h3-4,7,9,11,14-15H,2,5-6,8,10,12,18H2,1H3.
What are the key properties of 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine?
1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine has a molecular weight of 272.39 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-(2-ethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 43266458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).