1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol

C16H17NO2 — CID 66461322

IUPAC1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol
SMILESCc1ccc(CC(O)c2ccc3c(c2)CCO3)nc1
InChIInChI=1S/C16H17NO2/c1-11-2-4-14(17-10-11)9-15(18)12-3-5-16-13(8-12)6-7-19-16/h2-5,8,10,15,18H,6-7,9H2,1H3
InChIKeyBDPDKGUMYJNPLH-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.60
Rot. Bonds3

About 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol

1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol (PubChem CID 66461322) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol
PubChem CID66461322
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol
SMILESCc1ccc(CC(O)c2ccc3c(c2)CCO3)nc1
InChIInChI=1S/C16H17NO2/c1-11-2-4-14(17-10-11)9-15(18)12-3-5-16-13(8-12)6-7-19-16/h2-5,8,10,15,18H,6-7,9H2,1H3
InChIKeyBDPDKGUMYJNPLH-UHFFFAOYSA-N
XLogP2.60
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol with MolForge

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

Launch Full Analysis

Related Compounds

1-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methylphenyl)ethanol
CID 61100428
1-(2,3-dihydro-1-benzofuran-5-yl)butan-1-ol
CID 61100081
1-(2,3-dihydro-1-benzofuran-5-yl)-2-methoxyethanol
CID 79567949
1-(2,3-dihydro-1-benzofuran-5-yl)hexan-1-ol
CID 61099251
1-(2,3-dihydro-1-benzofuran-5-yl)-2-(furan-2-yl)ethanol
CID 83171228
2,3-dihydro-1-benzofuran-5-yl-(3,5-dimethylphenyl)methanol
CID 61099414
1-(2,3-dihydro-1-benzofuran-5-yl)-2-propan-2-yloxyethanol
CID 79567818
2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 62505676
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(3-methylphenyl)propan-1-ol
CID 105125289
1-(2,3-dihydro-1-benzofuran-5-yl)but-3-en-1-ol
CID 79734096
2-(2,3-dichlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 107307473
1-(3,4-dihydro-2H-chromen-6-yl)-2-(3,4-dimethylphenyl)ethanol
CID 62538318

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol (CID 66461322) is 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol is Cc1ccc(CC(O)c2ccc3c(c2)CCO3)nc1.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol?
The InChIKey is BDPDKGUMYJNPLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-11-2-4-14(17-10-11)9-15(18)12-3-5-16-13(8-12)6-7-19-16/h2-5,8,10,15,18H,6-7,9H2,1H3.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol?
1-(2,3-dihydro-1-benzofuran-5-yl)-2-(5-methyl-2-pyridinyl)ethanol has a molecular weight of 255.32 g/mol, XLogP of 2.60, 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-5-yl)-2-(5-methyl-2-pyridinyl)ethanol is sourced from PubChem (CID 66461322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).