2,3-dihydro-1-benzofuran-5-ylmethanamine

C9H11NO — CID 2735367

IUPAC2,3-dihydro-1-benzofuran-5-ylmethanamine
SMILESNCc1ccc2c(c1)CCO2
InChIInChI=1S/C9H11NO/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-2,5H,3-4,6,10H2
InChIKeyWQXWNTPLZFVZNX-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.08
Rot. Bonds1

About 2,3-dihydro-1-benzofuran-5-ylmethanamine

2,3-dihydro-1-benzofuran-5-ylmethanamine (PubChem CID 2735367) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-5-ylmethanamine.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-5-ylmethanamine
PubChem CID2735367
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name2,3-dihydro-1-benzofuran-5-ylmethanamine
SMILESNCc1ccc2c(c1)CCO2
InChIInChI=1S/C9H11NO/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-2,5H,3-4,6,10H2
InChIKeyWQXWNTPLZFVZNX-UHFFFAOYSA-N
XLogP1.08
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-5-ylmethanamine?
The IUPAC name of 2,3-dihydro-1-benzofuran-5-ylmethanamine (CID 2735367) is 2,3-dihydro-1-benzofuran-5-ylmethanamine.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-5-ylmethanamine?
The canonical SMILES for 2,3-dihydro-1-benzofuran-5-ylmethanamine is NCc1ccc2c(c1)CCO2.
What is the InChIKey of 2,3-dihydro-1-benzofuran-5-ylmethanamine?
The InChIKey is WQXWNTPLZFVZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-2,5H,3-4,6,10H2.
What are the key properties of 2,3-dihydro-1-benzofuran-5-ylmethanamine?
2,3-dihydro-1-benzofuran-5-ylmethanamine has a molecular weight of 149.19 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-5-ylmethanamine is sourced from PubChem (CID 2735367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).