1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol

C11H15NO2 — CID 82401989

IUPAC1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol
SMILESCC(O)(CN)c1ccc2c(c1)OCC2
InChIInChI=1S/C11H15NO2/c1-11(13,7-12)9-3-2-8-4-5-14-10(8)6-9/h2-3,6,13H,4-5,7,12H2,1H3
InChIKeyBYSYHPYTNIWEOU-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.79
Rot. Bonds2

About 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol

1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol (PubChem CID 82401989) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol
PubChem CID82401989
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol
SMILESCC(O)(CN)c1ccc2c(c1)OCC2
InChIInChI=1S/C11H15NO2/c1-11(13,7-12)9-3-2-8-4-5-14-10(8)6-9/h2-3,6,13H,4-5,7,12H2,1H3
InChIKeyBYSYHPYTNIWEOU-UHFFFAOYSA-N
XLogP0.79
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1-benzofuran-6-yl)-2-methylpropan-1-amine
CID 105426380
2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine
CID 105426382
2-(3,4-dihydro-2H-chromen-7-yl)-2-methylpropan-1-amine
CID 105426400
7-(1-amino-2-hydroxypropan-2-yl)-5-methyl-2,3-dihydro-1,5-benzoxazepin-4-one
CID 82480880
methyl 2-(2,3-dihydro-1-benzofuran-6-yl)-2-methylpropanoate
CID 105475567
6-(2-isocyanatopropan-2-yl)-2,3-dihydro-1-benzofuran
CID 105455223
6-(2,2-dimethylpropyl)-2,3-dihydro-1-benzofuran
CID 59832132
3-(2,3-dihydro-1-benzofuran-5-yl)-3-methylbutan-1-amine
CID 22592399
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydrazinylpropan-2-ol
CID 82080622
2-(2,3-dihydro-1-benzofuran-6-yl)ethanamine
CID 82415104
6-ethyl-2,3-dihydro-1-benzofuran
CID 59981216
4-amino-2-(1,3-benzodioxol-5-yl)butan-2-ol
CID 82395145

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol?
The IUPAC name of 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol (CID 82401989) is 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol.
What is the SMILES notation for 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol?
The canonical SMILES for 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol is CC(O)(CN)c1ccc2c(c1)OCC2.
What is the InChIKey of 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol?
The InChIKey is BYSYHPYTNIWEOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-11(13,7-12)9-3-2-8-4-5-14-10(8)6-9/h2-3,6,13H,4-5,7,12H2,1H3.
What are the key properties of 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol?
1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol has a molecular weight of 193.25 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol is sourced from PubChem (CID 82401989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).