1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine

C15H16N2O — CID 104736728

IUPAC1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)C1COc2ccccc21
InChIInChI=1S/C15H16N2O/c16-14(8-11-4-3-7-17-9-11)13-10-18-15-6-2-1-5-12(13)15/h1-7,9,13-14H,8,10,16H2
InChIKeyBGBJPFLTYBTXKR-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.13
Rot. Bonds3

About 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine

1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine (PubChem CID 104736728) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine
PubChem CID104736728
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)C1COc2ccccc21
InChIInChI=1S/C15H16N2O/c16-14(8-11-4-3-7-17-9-11)13-10-18-15-6-2-1-5-12(13)15/h1-7,9,13-14H,8,10,16H2
InChIKeyBGBJPFLTYBTXKR-UHFFFAOYSA-N
XLogP2.13
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine 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-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine (CID 104736728) is 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine is NC(Cc1cccnc1)C1COc2ccccc21.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine?
The InChIKey is BGBJPFLTYBTXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c16-14(8-11-4-3-7-17-9-11)13-10-18-15-6-2-1-5-12(13)15/h1-7,9,13-14H,8,10,16H2.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine?
1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine has a molecular weight of 240.31 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-3-yl)-2-pyridin-3-ylethanamine is sourced from PubChem (CID 104736728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).