2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol

C11H15NO2 — CID 117198906

IUPAC2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol
SMILESCNCCC1Cc2c(O)cccc2O1
InChIInChI=1S/C11H15NO2/c1-12-6-5-8-7-9-10(13)3-2-4-11(9)14-8/h2-4,8,12-13H,5-7H2,1H3
InChIKeyJIFFQYNPZUMSCC-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.31
Rot. Bonds3

About 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol

2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol (PubChem CID 117198906) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol.

Molecular Properties

Compound Name2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol
PubChem CID117198906
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol
SMILESCNCCC1Cc2c(O)cccc2O1
InChIInChI=1S/C11H15NO2/c1-12-6-5-8-7-9-10(13)3-2-4-11(9)14-8/h2-4,8,12-13H,5-7H2,1H3
InChIKeyJIFFQYNPZUMSCC-UHFFFAOYSA-N
XLogP1.31
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-propyl-2,3-dihydro-1-benzofuran
CID 141132371
N-methyl-2-(7-methyl-2,3-dihydro-1-benzofuran-2-yl)ethanamine
CID 70260688
3-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol
CID 117200214
(4-methyl-2,3-dihydro-1-benzofuran-2-yl)methanol
CID 23244647
(2R,3S)-2-prop-1-en-2-yl-3,4-dihydro-2H-chromene-3,5-diol
CID 143772338
4-hydroxy-2,3-dihydro-1-benzofuran-2-carboxylic acid
CID 14494068
2-methyl-1-(4-methyl-2,3-dihydro-1-benzofuran-2-yl)propan-2-ol
CID 117198214
1-(4-bromo-2,3-dihydro-1-benzofuran-2-yl)-N-methylpropan-2-amine
CID 117198427
N-methyl-2-(4-methyl-2,3-dihydro-1H-indol-2-yl)ethanamine
CID 117198308
1-(4-chloro-2,3-dihydro-1-benzofuran-2-yl)propan-2-one
CID 117198387
N-[3-[2-(4-phenylbutyl)-2,3-dihydro-1-benzofuran-4-yl]propyl]acetamide
CID 11725518
2,3,4,4a,5,10a-hexahydropyrano[2,3-b]chromen-6-ol
CID 134691344

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol?
The IUPAC name of 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol (CID 117198906) is 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol.
What is the SMILES notation for 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol?
The canonical SMILES for 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol is CNCCC1Cc2c(O)cccc2O1.
What is the InChIKey of 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol?
The InChIKey is JIFFQYNPZUMSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-12-6-5-8-7-9-10(13)3-2-4-11(9)14-8/h2-4,8,12-13H,5-7H2,1H3.
What are the key properties of 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol?
2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol has a molecular weight of 193.25 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethyl]-2,3-dihydro-1-benzofuran-4-ol is sourced from PubChem (CID 117198906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).