2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol

C15H15NO2 — CID 114744728

IUPAC2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol
SMILESCc1cnccc1C(O)c1cccc2c1OCC2
InChIInChI=1S/C15H15NO2/c1-10-9-16-7-5-12(10)14(17)13-4-2-3-11-6-8-18-15(11)13/h2-5,7,9,14,17H,6,8H2,1H3
InChIKeyUDFDFBYIDFGWDQ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.41
Rot. Bonds2

About 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol

2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol (PubChem CID 114744728) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol
PubChem CID114744728
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol
SMILESCc1cnccc1C(O)c1cccc2c1OCC2
InChIInChI=1S/C15H15NO2/c1-10-9-16-7-5-12(10)14(17)13-4-2-3-11-6-8-18-15(11)13/h2-5,7,9,14,17H,6,8H2,1H3
InChIKeyUDFDFBYIDFGWDQ-UHFFFAOYSA-N
XLogP2.41
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethylphenyl)methanol
CID 114743334
3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol
CID 114743328
2,3-dihydro-1-benzofuran-7-yl-(2-iodophenyl)methanol
CID 115838946
1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 68614116
(2-chlorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 114743289
2,3-dihydro-1-benzofuran-7-yl(naphthalen-1-yl)methanol
CID 114743291
[2-(difluoromethoxy)phenyl]-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 114743255
2,3-dihydro-1-benzofuran-7-yl-(1-methylimidazol-4-yl)methanol
CID 107978736
[2,3-dihydro-1-benzofuran-7-yl-(3-methoxy-4-pyridinyl)methyl]hydrazine
CID 105341902
(2-bromo-3,4-difluorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 107538425
2,3-dihydro-1-benzofuran-7-yl-(2-fluoro-4-methoxyphenyl)methanol
CID 114744709
2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol
CID 114743786

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol?
The IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol (CID 114744728) is 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol?
The canonical SMILES for 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol is Cc1cnccc1C(O)c1cccc2c1OCC2.
What is the InChIKey of 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol?
The InChIKey is UDFDFBYIDFGWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-10-9-16-7-5-12(10)14(17)13-4-2-3-11-6-8-18-15(11)13/h2-5,7,9,14,17H,6,8H2,1H3.
What are the key properties of 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol?
2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol has a molecular weight of 241.29 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol is sourced from PubChem (CID 114744728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).