1-benzofuran-2-ylmethanamine;hydrochloride

C9H10ClNO — CID 22467483

IUPAC1-benzofuran-2-ylmethanamine;hydrochloride
SMILESCl.NCc1cc2ccccc2o1
InChIInChI=1S/C9H9NO.ClH/c10-6-8-5-7-3-1-2-4-9(7)11-8;/h1-5H,6,10H2;1H
InChIKeyORSCEBONMBYAHW-UHFFFAOYSA-N
MW183.64 g/mol
LogP2.31
Rot. Bonds1

About 1-benzofuran-2-ylmethanamine;hydrochloride

1-benzofuran-2-ylmethanamine;hydrochloride (PubChem CID 22467483) has the molecular formula C9H10ClNO and a molecular weight of 183.64 g/mol. Its IUPAC name is 1-benzofuran-2-ylmethanamine;hydrochloride.

Molecular Properties

Compound Name1-benzofuran-2-ylmethanamine;hydrochloride
PubChem CID22467483
Molecular FormulaC9H10ClNO
Molecular Weight183.64 g/mol
Exact Mass183.05
IUPAC Name1-benzofuran-2-ylmethanamine;hydrochloride
SMILESCl.NCc1cc2ccccc2o1
InChIInChI=1S/C9H9NO.ClH/c10-6-8-5-7-3-1-2-4-9(7)11-8;/h1-5H,6,10H2;1H
InChIKeyORSCEBONMBYAHW-UHFFFAOYSA-N
XLogP2.31
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-benzofuran-2-ylmethanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-ylmethanamine;hydrochloride?
The IUPAC name of 1-benzofuran-2-ylmethanamine;hydrochloride (CID 22467483) is 1-benzofuran-2-ylmethanamine;hydrochloride.
What is the SMILES notation for 1-benzofuran-2-ylmethanamine;hydrochloride?
The canonical SMILES for 1-benzofuran-2-ylmethanamine;hydrochloride is Cl.NCc1cc2ccccc2o1.
What is the InChIKey of 1-benzofuran-2-ylmethanamine;hydrochloride?
The InChIKey is ORSCEBONMBYAHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO.ClH/c10-6-8-5-7-3-1-2-4-9(7)11-8;/h1-5H,6,10H2;1H.
What are the key properties of 1-benzofuran-2-ylmethanamine;hydrochloride?
1-benzofuran-2-ylmethanamine;hydrochloride has a molecular weight of 183.64 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-ylmethanamine;hydrochloride is sourced from PubChem (CID 22467483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).