6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine

C16H24N2O2 — CID 107911089

IUPAC6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine
SMILESCN1CCCCC1CCOc1ccc2c(c1)OCC2N
InChIInChI=1S/C16H24N2O2/c1-18-8-3-2-4-12(18)7-9-19-13-5-6-14-15(17)11-20-16(14)10-13/h5-6,10,12,15H,2-4,7-9,11,17H2,1H3
InChIKeyXCILSWGVEUNGDN-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.33
Rot. Bonds4

About 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine

6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 107911089) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine
PubChem CID107911089
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine
SMILESCN1CCCCC1CCOc1ccc2c(c1)OCC2N
InChIInChI=1S/C16H24N2O2/c1-18-8-3-2-4-12(18)7-9-19-13-5-6-14-15(17)11-20-16(14)10-13/h5-6,10,12,15H,2-4,7-9,11,17H2,1H3
InChIKeyXCILSWGVEUNGDN-UHFFFAOYSA-N
XLogP2.33
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine
CID 70628177
7-[2-(1-methylpiperidin-2-yl)ethoxy]-3-phenyl-2,3-dihydrochromen-4-one
CID 21287367
[3-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]methanamine
CID 106485036
2-[[(3R)-3-amino-2,3-dihydro-1-benzofuran-6-yl]oxy]ethanol
CID 130038415
2-[2-(3-ethylphenoxy)ethyl]-1-methylpiperidine
CID 103616830
1-methyl-2-(2-phenoxyethyl)piperidine
CID 23339547
[4-[2-(1-methylpyrrolidin-2-yl)ethoxy]phenyl]methanamine
CID 61102124
(1R)-1-[3-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]ethanol
CID 107912832
6-[2-(1-methylimidazol-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine
CID 114527225
6-(3-methylsulfonylpropoxy)-2,3-dihydro-1-benzofuran-3-amine
CID 63190974
[2-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]phenyl]methanamine
CID 81279315
1-[2-bromo-5-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]-N-methylmethanamine
CID 107911135

Frequently Asked Questions

What is the IUPAC name of 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine (CID 107911089) is 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine is CN1CCCCC1CCOc1ccc2c(c1)OCC2N.
What is the InChIKey of 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is XCILSWGVEUNGDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18-8-3-2-4-12(18)7-9-19-13-5-6-14-15(17)11-20-16(14)10-13/h5-6,10,12,15H,2-4,7-9,11,17H2,1H3.
What are the key properties of 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine?
6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 276.38 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(1-methylpiperidin-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 107911089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).