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

C9H11NO2 — CID 67212522

IUPAC4-methoxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCOc1cccc2c1C(N)CO2
InChIInChI=1S/C9H11NO2/c1-11-7-3-2-4-8-9(7)6(10)5-12-8/h2-4,6H,5,10H2,1H3
InChIKeyHJDRZCNWTNXKQN-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.09
Rot. Bonds1

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

4-methoxy-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 67212522) 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-3-amine.

Molecular Properties

Compound Name4-methoxy-2,3-dihydro-1-benzofuran-3-amine
PubChem CID67212522
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name4-methoxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCOc1cccc2c1C(N)CO2
InChIInChI=1S/C9H11NO2/c1-11-7-3-2-4-8-9(7)6(10)5-12-8/h2-4,6H,5,10H2,1H3
InChIKeyHJDRZCNWTNXKQN-UHFFFAOYSA-N
XLogP1.09
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 ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 4-methoxy-2,3-dihydro-1-benzofuran-3-amine (CID 67212522) is 4-methoxy-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 4-methoxy-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 4-methoxy-2,3-dihydro-1-benzofuran-3-amine is COc1cccc2c1C(N)CO2.
What is the InChIKey of 4-methoxy-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is HJDRZCNWTNXKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-11-7-3-2-4-8-9(7)6(10)5-12-8/h2-4,6H,5,10H2,1H3.
What are the key properties of 4-methoxy-2,3-dihydro-1-benzofuran-3-amine?
4-methoxy-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 165.19 g/mol, XLogP of 1.09, 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-3-amine is sourced from PubChem (CID 67212522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).