5-methoxy-2,3-dihydro-1-benzofuran-4-amine

C9H11NO2 — CID 82373067

IUPAC5-methoxy-2,3-dihydro-1-benzofuran-4-amine
SMILESCOc1ccc2c(c1N)CCO2
InChIInChI=1S/C9H11NO2/c1-11-8-3-2-7-6(9(8)10)4-5-12-7/h2-3H,4-5,10H2,1H3
InChIKeyTYRXVQWIGTWKMD-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.21
Rot. Bonds1

About 5-methoxy-2,3-dihydro-1-benzofuran-4-amine

5-methoxy-2,3-dihydro-1-benzofuran-4-amine (PubChem CID 82373067) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is 5-methoxy-2,3-dihydro-1-benzofuran-4-amine.

Molecular Properties

Compound Name5-methoxy-2,3-dihydro-1-benzofuran-4-amine
PubChem CID82373067
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name5-methoxy-2,3-dihydro-1-benzofuran-4-amine
SMILESCOc1ccc2c(c1N)CCO2
InChIInChI=1S/C9H11NO2/c1-11-8-3-2-7-6(9(8)10)4-5-12-7/h2-3H,4-5,10H2,1H3
InChIKeyTYRXVQWIGTWKMD-UHFFFAOYSA-N
XLogP1.21
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-methoxy-2,3-dihydro-1-benzofuran-4-ol
CID 105432938
4-bromo-5-methoxy-2,3-dihydro-1-benzofuran
CID 83918290
methyl 5-methoxy-2,3-dihydro-1-benzofuran-4-carboxylate
CID 10081776
4-methoxy-2,3-dihydro-1-benzofuran-7-amine
CID 82373059
(2-amino-3-methoxyphenyl)-(2,3-dihydro-1-benzofuran-5-yl)methanone
CID 107469285
(7-methoxy-2,3-dihydro-1-benzofuran-4-yl)methanamine
CID 84767883
4-fluoro-2,3-dihydro-1-benzofuran-5-amine
CID 82373061
5-fluoro-6-methoxy-2,3-dihydrochromen-4-one
CID 55269506
2-amino-2-(7-methoxy-2,3-dihydro-1-benzofuran-4-yl)ethanol
CID 84780583
(2-methoxyphenyl) 2,3-dihydro-1-benzofuran-5-carboxylate
CID 47160994
4-prop-2-enyl-5-[(4-prop-2-enyl-2,3-dihydro-1-benzofuran-5-yl)oxy]-2,3-dihydro-1-benzofuran
CID 66780375
7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine
CID 84664224

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2,3-dihydro-1-benzofuran-4-amine?
The IUPAC name of 5-methoxy-2,3-dihydro-1-benzofuran-4-amine (CID 82373067) is 5-methoxy-2,3-dihydro-1-benzofuran-4-amine.
What is the SMILES notation for 5-methoxy-2,3-dihydro-1-benzofuran-4-amine?
The canonical SMILES for 5-methoxy-2,3-dihydro-1-benzofuran-4-amine is COc1ccc2c(c1N)CCO2.
What is the InChIKey of 5-methoxy-2,3-dihydro-1-benzofuran-4-amine?
The InChIKey is TYRXVQWIGTWKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-11-8-3-2-7-6(9(8)10)4-5-12-7/h2-3H,4-5,10H2,1H3.
What are the key properties of 5-methoxy-2,3-dihydro-1-benzofuran-4-amine?
5-methoxy-2,3-dihydro-1-benzofuran-4-amine has a molecular weight of 165.19 g/mol, XLogP of 1.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2,3-dihydro-1-benzofuran-4-amine is sourced from PubChem (CID 82373067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).