1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol

C16H21NO2 — CID 116685567

IUPAC1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol
SMILESCC1CCCC(CC(O)c2cc3ccccc3o2)N1
InChIInChI=1S/C16H21NO2/c1-11-5-4-7-13(17-11)10-14(18)16-9-12-6-2-3-8-15(12)19-16/h2-3,6,8-9,11,13-14,17-18H,4-5,7,10H2,1H3
InChIKeyYDSDZWOKURWZIZ-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.39
Rot. Bonds3

About 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol

1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol (PubChem CID 116685567) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol
PubChem CID116685567
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol
SMILESCC1CCCC(CC(O)c2cc3ccccc3o2)N1
InChIInChI=1S/C16H21NO2/c1-11-5-4-7-13(17-11)10-14(18)16-9-12-6-2-3-8-15(12)19-16/h2-3,6,8-9,11,13-14,17-18H,4-5,7,10H2,1H3
InChIKeyYDSDZWOKURWZIZ-UHFFFAOYSA-N
XLogP3.39
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)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-(1-benzofuran-2-yl)-2-pyrrolidin-2-ylethanol
CID 79559824
1-benzofuran-2-yl-(2-methylcyclopentyl)methanol
CID 107192946
2-(6-methylpiperidin-2-yl)-1-thiophen-2-ylethanol
CID 116685593
1-(1-benzofuran-2-yl)-2-(2,3-dimethylpiperidin-1-yl)ethanol
CID 62123428
1-benzofuran-2-yl(cyclohexyl)methanol
CID 63090422
1-(1-benzofuran-2-yl)-2-[cyclopentylmethyl(methyl)amino]ethanol
CID 63631810
2-(6-methylpiperidin-2-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 116685555
1-(4-bromo-2-chlorophenyl)-2-(6-methylpiperidin-2-yl)ethanol
CID 116685604
1-(3-chloro-4-fluorophenyl)-2-(6-methylpiperidin-2-yl)ethanol
CID 116685744
1-benzofuran-2-yl-(2-methylcyclopentyl)methanamine
CID 107191076
1-(1-benzofuran-2-yl)-N-[(2-methylcyclopentyl)methyl]ethanamine
CID 107417019
N-[1-(1-benzofuran-2-yl)ethyl]cyclopropanamine
CID 18071242

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol (CID 116685567) is 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol is CC1CCCC(CC(O)c2cc3ccccc3o2)N1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol?
The InChIKey is YDSDZWOKURWZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-11-5-4-7-13(17-11)10-14(18)16-9-12-6-2-3-8-15(12)19-16/h2-3,6,8-9,11,13-14,17-18H,4-5,7,10H2,1H3.
What are the key properties of 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol?
1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol has a molecular weight of 259.35 g/mol, XLogP of 3.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-(6-methylpiperidin-2-yl)ethanol is sourced from PubChem (CID 116685567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).