4-methoxy-2,3-dihydro-1-benzofuran-7-amine

C9H11NO2 — CID 82373059

IUPAC4-methoxy-2,3-dihydro-1-benzofuran-7-amine
SMILESCOc1ccc(N)c2c1CCO2
InChIInChI=1S/C9H11NO2/c1-11-8-3-2-7(10)9-6(8)4-5-12-9/h2-3H,4-5,10H2,1H3
InChIKeyPMKNQUSGJAGDFE-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.21
Rot. Bonds1

About 4-methoxy-2,3-dihydro-1-benzofuran-7-amine

4-methoxy-2,3-dihydro-1-benzofuran-7-amine (PubChem CID 82373059) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is 4-methoxy-2,3-dihydro-1-benzofuran-7-amine.

Molecular Properties

Compound Name4-methoxy-2,3-dihydro-1-benzofuran-7-amine
PubChem CID82373059
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name4-methoxy-2,3-dihydro-1-benzofuran-7-amine
SMILESCOc1ccc(N)c2c1CCO2
InChIInChI=1S/C9H11NO2/c1-11-8-3-2-7(10)9-6(8)4-5-12-9/h2-3H,4-5,10H2,1H3
InChIKeyPMKNQUSGJAGDFE-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-amino-8-methoxy-2,3-dihydrochromen-4-one
CID 4228364
5-methoxy-2,3-dihydro-1-benzofuran-4-amine
CID 82373067
(7-methoxy-2,3-dihydro-1-benzofuran-4-yl)methanamine
CID 84767883
5-methoxy-3,4-dihydro-2H-chromene-8-sulfonamide
CID 91142741
2-amino-2-(7-methoxy-2,3-dihydro-1-benzofuran-4-yl)ethanol
CID 84780583
6-methoxy-2,3-dihydro-1-benzofuran-7-thiol
CID 168942495
5-methoxy-2,3-dihydro-1-benzofuran-4-ol
CID 105432938
4-bromo-5-methoxy-2,3-dihydro-1-benzofuran
CID 83918290
7-bromo-6-methoxy-2,3-dihydro-1-benzofuran
CID 84692337
(7-methoxy-2,3-dihydro-1-benzofuran-4-yl)methanesulfonyl chloride
CID 84807123
3-(7-methoxy-2,3-dihydro-1-benzofuran-4-yl)propanenitrile
CID 84777196
5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-8-amine
CID 84664219

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,3-dihydro-1-benzofuran-7-amine?
The IUPAC name of 4-methoxy-2,3-dihydro-1-benzofuran-7-amine (CID 82373059) is 4-methoxy-2,3-dihydro-1-benzofuran-7-amine.
What is the SMILES notation for 4-methoxy-2,3-dihydro-1-benzofuran-7-amine?
The canonical SMILES for 4-methoxy-2,3-dihydro-1-benzofuran-7-amine is COc1ccc(N)c2c1CCO2.
What is the InChIKey of 4-methoxy-2,3-dihydro-1-benzofuran-7-amine?
The InChIKey is PMKNQUSGJAGDFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-11-8-3-2-7(10)9-6(8)4-5-12-9/h2-3H,4-5,10H2,1H3.
What are the key properties of 4-methoxy-2,3-dihydro-1-benzofuran-7-amine?
4-methoxy-2,3-dihydro-1-benzofuran-7-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 4-methoxy-2,3-dihydro-1-benzofuran-7-amine is sourced from PubChem (CID 82373059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).