1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol

C16H19NO3 — CID 66372336

IUPAC1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol
SMILESOC(CN1CC2CCC(C1)O2)c1cc2ccccc2o1
InChIInChI=1S/C16H19NO3/c18-14(10-17-8-12-5-6-13(9-17)19-12)16-7-11-3-1-2-4-15(11)20-16/h1-4,7,12-14,18H,5-6,8-10H2
InChIKeyCHUHAXFCBXZMEA-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.33
Rot. Bonds3

About 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol

1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol (PubChem CID 66372336) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol
PubChem CID66372336
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol
SMILESOC(CN1CC2CCC(C1)O2)c1cc2ccccc2o1
InChIInChI=1S/C16H19NO3/c18-14(10-17-8-12-5-6-13(9-17)19-12)16-7-11-3-1-2-4-15(11)20-16/h1-4,7,12-14,18H,5-6,8-10H2
InChIKeyCHUHAXFCBXZMEA-UHFFFAOYSA-N
XLogP2.33
TPSA45.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-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-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanamine
CID 66394022
(1R)-2-[(3aR,6aS)-2,2-dioxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-c]pyrrol-5-yl]-1-(1-benzofuran-2-yl)ethanol
CID 136585973
2-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanamine
CID 66391481
1-(2-methylphenyl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol
CID 66370370
1-(1-benzofuran-2-yl)-2-(2,3-dimethylpiperidin-1-yl)ethanol
CID 62123428
1-(1-benzofuran-2-yl)-2-[4-(triazol-1-ylmethyl)piperidin-1-yl]ethanol
CID 136562540
1-[2-(1-benzofuran-2-yl)-2-hydroxyethyl]-3,4-dimethylpyrrolidine-2,5-dione
CID 79179188
(1R)-1-(1-benzofuran-2-yl)butane-1,4-diol
CID 124681415
1-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanol
CID 63024740
(1R)-2-(1-azaspiro[3.3]heptan-1-yl)-1-(1-benzofuran-2-yl)ethanol
CID 154795462
1-benzofuran-2-yl(cyclohexyl)methanol
CID 63090422
1-(1-benzofuran-2-yl)-4,4,4-trifluorobutan-1-ol
CID 64566757

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol (CID 66372336) is 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol is OC(CN1CC2CCC(C1)O2)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol?
The InChIKey is CHUHAXFCBXZMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c18-14(10-17-8-12-5-6-13(9-17)19-12)16-7-11-3-1-2-4-15(11)20-16/h1-4,7,12-14,18H,5-6,8-10H2.
What are the key properties of 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol?
1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol has a molecular weight of 273.33 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol is sourced from PubChem (CID 66372336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).