1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol

C17H15ClO3 — CID 114726331

IUPAC1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C17H15ClO3/c1-20-15-5-3-2-4-11(15)9-14(19)17-10-12-8-13(18)6-7-16(12)21-17/h2-8,10,14,19H,9H2,1H3
InChIKeyUXTGCYQIXCFIFD-UHFFFAOYSA-N
MW302.76 g/mol
LogP4.37
Rot. Bonds4

About 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol

1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol (PubChem CID 114726331) has the molecular formula C17H15ClO3 and a molecular weight of 302.76 g/mol. Its IUPAC name is 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol
PubChem CID114726331
Molecular FormulaC17H15ClO3
Molecular Weight302.76 g/mol
Exact Mass302.07
IUPAC Name1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C17H15ClO3/c1-20-15-5-3-2-4-11(15)9-14(19)17-10-12-8-13(18)6-7-16(12)21-17/h2-8,10,14,19H,9H2,1H3
InChIKeyUXTGCYQIXCFIFD-UHFFFAOYSA-N
XLogP4.37
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)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-(5-chloro-1-benzofuran-2-yl)-2-(4-chlorophenyl)ethanol
CID 114726287
1-(5-chloro-2-fluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 55151769
(1S)-1-(5-chloro-1-benzofuran-2-yl)propan-1-ol
CID 96826863
1-(5-chloro-1-benzofuran-2-yl)-2-(6-methoxy-3-pyridinyl)ethanol
CID 114727014
1-(3,5-dichlorophenyl)-2-(2-methoxyphenyl)ethanol
CID 63016213
1-(5-chloro-2-methoxyphenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 62608604
2-[1-chloro-2-(2-methoxyphenyl)ethyl]-1-benzofuran
CID 63542473
1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol
CID 114726361
2-[1-bromo-2-(2-methoxyphenyl)ethyl]-5-methyl-1-benzofuran
CID 63542288
2-(5-chloro-2-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 103053486
1-(5-chloro-1-benzofuran-2-yl)-4-methoxypentan-1-ol
CID 105129366
1-(5-chloro-1-benzofuran-2-yl)-2-propan-2-yloxyethanol
CID 105129479

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol (CID 114726331) is 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol is COc1ccccc1CC(O)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol?
The InChIKey is UXTGCYQIXCFIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClO3/c1-20-15-5-3-2-4-11(15)9-14(19)17-10-12-8-13(18)6-7-16(12)21-17/h2-8,10,14,19H,9H2,1H3.
What are the key properties of 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol?
1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol has a molecular weight of 302.76 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 114726331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).