2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine

C12H17NO2 — CID 114743871

IUPAC2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine
SMILESCOCC(C)(N)c1cccc2c1OCC2
InChIInChI=1S/C12H17NO2/c1-12(13,8-14-2)10-5-3-4-9-6-7-15-11(9)10/h3-5H,6-8,13H2,1-2H3
InChIKeyREBXKHONSZCYPD-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.44
Rot. Bonds3

About 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine

2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine (PubChem CID 114743871) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine
PubChem CID114743871
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine
SMILESCOCC(C)(N)c1cccc2c1OCC2
InChIInChI=1S/C12H17NO2/c1-12(13,8-14-2)10-5-3-4-9-6-7-15-11(9)10/h3-5H,6-8,13H2,1-2H3
InChIKeyREBXKHONSZCYPD-UHFFFAOYSA-N
XLogP1.44
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1-benzofuran-7-yl)-1-(4-methoxyphenyl)propan-2-amine
CID 114743879
7-(2,4,4-trimethylpentan-2-yl)-2,3-dihydro-1-benzofuran
CID 173236217
1-(2,3-dihydro-1-benzofuran-7-yl)-1-(4-methylphenyl)ethanamine
CID 114743817
1-(3-bromophenyl)-1-(2,3-dihydro-1-benzofuran-7-yl)ethanamine
CID 114743837
1-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-7-yl)ethanamine
CID 114743831
4-(2,3-dihydro-1-benzofuran-7-yl)-4-methylpentan-2-one
CID 114746860
2-(2,3-dihydro-1-benzofuran-7-yl)-4-methylpentan-2-ol
CID 114743757
3-(2,3-dihydro-1-benzofuran-7-ylsulfonylamino)-4-methoxy-3-methylbutanoic acid
CID 154865108
(2S)-2-(aminomethyl)-4-(2,3-dihydro-1-benzofuran-7-yl)-1,1,1-trifluoro-4-methylpentan-2-ol
CID 15605604
2-(3,4-dihydro-2H-chromen-8-yl)-2-fluoro-3,3-dimethylbutan-1-amine
CID 114747718
3-(3,4-dihydro-2H-chromen-8-yl)-3-methylbutan-1-amine
CID 114747537
1-(3,4-dihydro-2H-chromen-8-yl)-1-(2-methylphenyl)ethanamine
CID 114743820

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine (CID 114743871) is 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine is COCC(C)(N)c1cccc2c1OCC2.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine?
The InChIKey is REBXKHONSZCYPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-12(13,8-14-2)10-5-3-4-9-6-7-15-11(9)10/h3-5H,6-8,13H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine?
2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine has a molecular weight of 207.27 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-7-yl)-1-methoxypropan-2-amine is sourced from PubChem (CID 114743871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).