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

C19H29NO2 — CID 11001174

IUPAC1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine
SMILESCC(ON1C(C)(C)CCCC1(C)C)C1COc2ccccc21
InChIInChI=1S/C19H29NO2/c1-14(16-13-21-17-10-7-6-9-15(16)17)22-20-18(2,3)11-8-12-19(20,4)5/h6-7,9-10,14,16H,8,11-13H2,1-5H3
InChIKeyAJMVAAOMACUUNH-UHFFFAOYSA-N
MW303.45 g/mol
LogP4.53
Rot. Bonds3

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

1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine (PubChem CID 11001174) has the molecular formula C19H29NO2 and a molecular weight of 303.45 g/mol. Its IUPAC name is 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine
PubChem CID11001174
Molecular FormulaC19H29NO2
Molecular Weight303.45 g/mol
Exact Mass303.22
IUPAC Name1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine
SMILESCC(ON1C(C)(C)CCCC1(C)C)C1COc2ccccc21
InChIInChI=1S/C19H29NO2/c1-14(16-13-21-17-10-7-6-9-15(16)17)22-20-18(2,3)11-8-12-19(20,4)5/h6-7,9-10,14,16H,8,11-13H2,1-5H3
InChIKeyAJMVAAOMACUUNH-UHFFFAOYSA-N
XLogP4.53
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Isopropylphenyl 4-(1-piperidinyl)butyl ether
CID 1825301
1-((3-Methyl-2,3-dihydrobenzofuran-2-yl)methyl)piperidine
CID 44421057
1-(2,3-Dihydrobenzofuran-3-ylmethoxy)-2,2,6,6-tetramethylpiperidine
CID 12709388
1-[[(2R,3S)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine
CID 73357270
1-[2-[(3-methyl-2H-1-benzofuran-3-yl)methyl]prop-2-enyl]piperidine
CID 12982688
4-(2,3-Dihydro-1-benzofuran-3-yl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxybutanenitrile
CID 102100110
1-(2,3-Dihydro-1-benzofuran-3-ylmethoxy)-2,2,6,6-tetramethyl-4-prop-2-ynoxypiperidine
CID 135031861
[1-(2,3-Dihydro-1-benzofuran-3-ylmethoxy)-2,2,6,6-tetramethylpiperidin-4-yl] 4-methylbenzenesulfonate
CID 135031862
1-(2,3-Dihydro-1-benzofuran-3-ylmethoxy)-2,6-diethyl-2,3,6-trimethylpiperidine
CID 135031863
1-(2,3-Dihydro-1-benzofuran-3-ylmethoxy)-4-methoxy-2,2,6,6-tetramethylpiperidine
CID 135031864
1-(2,3-Dihydro-1-benzofuran-3-ylmethoxy)-2,2,6,6-tetramethylpiperidin-4-one
CID 135031865
1-(2,3-Dihydro-1-benzofuran-3-ylmethoxy)-2,2,6,6-tetramethylpiperidin-4-ol
CID 135031867

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine (CID 11001174) is 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine is CC(ON1C(C)(C)CCCC1(C)C)C1COc2ccccc21.
What is the InChIKey of 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine?
The InChIKey is AJMVAAOMACUUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO2/c1-14(16-13-21-17-10-7-6-9-15(16)17)22-20-18(2,3)11-8-12-19(20,4)5/h6-7,9-10,14,16H,8,11-13H2,1-5H3.
What are the key properties of 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine?
1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine has a molecular weight of 303.45 g/mol, XLogP of 4.53, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2,3-dihydro-1-benzofuran-3-yl)ethoxy]-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 11001174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).