1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol

C20H15NO2 — CID 91098140

IUPAC1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol
SMILESOC(c1ccccc1)(c1cccnc1)c1cc2ccccc2o1
InChIInChI=1S/C20H15NO2/c22-20(16-8-2-1-3-9-16,17-10-6-12-21-14-17)19-13-15-7-4-5-11-18(15)23-19/h1-14,22H
InChIKeyUBRRDPONEXGGOB-UHFFFAOYSA-N
MW301.35 g/mol
LogP4.11
Rot. Bonds3

About 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol

1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol (PubChem CID 91098140) has the molecular formula C20H15NO2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol.

Molecular Properties

Compound Name1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol
PubChem CID91098140
Molecular FormulaC20H15NO2
Molecular Weight301.35 g/mol
Exact Mass301.11
IUPAC Name1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol
SMILESOC(c1ccccc1)(c1cccnc1)c1cc2ccccc2o1
InChIInChI=1S/C20H15NO2/c22-20(16-8-2-1-3-9-16,17-10-6-12-21-14-17)19-13-15-7-4-5-11-18(15)23-19/h1-14,22H
InChIKeyUBRRDPONEXGGOB-UHFFFAOYSA-N
XLogP4.11
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Furegrelate
CID 3437
Furegrelate Sodium
CID 23724912
4-(2-Benzofuranyl)pyridine
CID 65590
Inicarone
CID 65811
3-(Pyridin-2-ylsulfanylmethyl)-benzofuran-2-carboxylic acid
CID 646827
6-Methoxybenzofuran-2-yl-(4-fluorophenyl)-3-pyridylmethanol
CID 10020714
6-Methoxybenzofuran-2-yl-(4-chlorophenyl)-3-pyridylmethanol
CID 10361506
(6-Methoxybenzofuran-2-yl)-(4-methoxyphenyl)-3-pyridyl-methanol
CID 11624690
1-{[(E)-Pyridin-4-ylmethylimino]-methyl}-6,7,8,9-tetrahydro-dibenzofuran-2-ol
CID 916087
3-(Benzofuran-2-ylmethylene)anabaseine
CID 10338609
Sodium 5-(3-pyridinylmethyl)-2-benzofurancarboxylate
CID 23663954
(5-Methyl-2-Furyl)(Pyridin-3-Yl)Methanol
CID 649084

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol?
The IUPAC name of 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol (CID 91098140) is 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol.
What is the SMILES notation for 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol?
The canonical SMILES for 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol is OC(c1ccccc1)(c1cccnc1)c1cc2ccccc2o1.
What is the InChIKey of 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol?
The InChIKey is UBRRDPONEXGGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO2/c22-20(16-8-2-1-3-9-16,17-10-6-12-21-14-17)19-13-15-7-4-5-11-18(15)23-19/h1-14,22H.
What are the key properties of 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol?
1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol has a molecular weight of 301.35 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-phenyl-pyridin-3-ylmethanol is sourced from PubChem (CID 91098140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).