2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol

C16H16O2 — CID 61100251

IUPAC2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol
SMILESCc1cccc(C(O)c2ccc3c(c2)CCO3)c1
InChIInChI=1S/C16H16O2/c1-11-3-2-4-13(9-11)16(17)14-5-6-15-12(10-14)7-8-18-15/h2-6,9-10,16-17H,7-8H2,1H3
InChIKeyLUCXQCJHOXNCOX-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.01
Rot. Bonds2

About 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol

2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol (PubChem CID 61100251) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol
PubChem CID61100251
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol
SMILESCc1cccc(C(O)c2ccc3c(c2)CCO3)c1
InChIInChI=1S/C16H16O2/c1-11-3-2-4-13(9-11)16(17)14-5-6-15-12(10-14)7-8-18-15/h2-6,9-10,16-17H,7-8H2,1H3
InChIKeyLUCXQCJHOXNCOX-UHFFFAOYSA-N
XLogP3.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol 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

2,3-dihydro-1-benzofuran-5-yl-(3,5-dimethylphenyl)methanol
CID 61099414
2,3-dihydro-1-benzofuran-5-yl-(2,6-dimethylphenyl)methanol
CID 104542171
2,3-dihydro-1-benzofuran-5-yl-(3-propylphenyl)methanol
CID 116542515
2,3-dihydro-1-benzofuran-5-yl-(2,4,6-trimethylphenyl)methanol
CID 61100080
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(3-methylphenyl)propan-1-ol
CID 105125289
(3,4-difluorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methanol
CID 61100595
(3,5-dichlorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methanol
CID 61100429
2,3-dihydro-1-benzofuran-5-yl-(3,5-dimethoxyphenyl)methanol
CID 61100594
2,3-dihydro-1,4-benzodioxin-5-yl(2,3-dihydro-1-benzofuran-5-yl)methanol
CID 105125287
1-(2,3-dihydro-1-benzofuran-5-yl)-2-(3-methylphenyl)ethanamine
CID 55068178
2,3-dihydro-1-benzofuran-5-yl-(3,5-dimethylphenyl)methanamine
CID 43198444
2,3-dihydro-1-benzofuran-5-yl-[4-(methoxymethyl)phenyl]methanol
CID 104542108

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol?
The IUPAC name of 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol (CID 61100251) is 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol?
The canonical SMILES for 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol is Cc1cccc(C(O)c2ccc3c(c2)CCO3)c1.
What is the InChIKey of 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol?
The InChIKey is LUCXQCJHOXNCOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-11-3-2-4-13(9-11)16(17)14-5-6-15-12(10-14)7-8-18-15/h2-6,9-10,16-17H,7-8H2,1H3.
What are the key properties of 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol?
2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol has a molecular weight of 240.30 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-5-yl-(3-methylphenyl)methanol is sourced from PubChem (CID 61100251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).