furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol

C17H15NO3 — CID 57340430

IUPACfuran-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol
SMILESCOc1ccc(C(O)(c2cccnc2)c2ccco2)cc1
InChIInChI=1S/C17H15NO3/c1-20-15-8-6-13(7-9-15)17(19,16-5-3-11-21-16)14-4-2-10-18-12-14/h2-12,19H,1H3
InChIKeyZHGPKFOAHZEJBZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.97
Rot. Bonds4

About furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol

furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol (PubChem CID 57340430) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Namefuran-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol
PubChem CID57340430
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Namefuran-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol
SMILESCOc1ccc(C(O)(c2cccnc2)c2ccco2)cc1
InChIInChI=1S/C17H15NO3/c1-20-15-8-6-13(7-9-15)17(19,16-5-3-11-21-16)14-4-2-10-18-12-14/h2-12,19H,1H3
InChIKeyZHGPKFOAHZEJBZ-UHFFFAOYSA-N
XLogP2.97
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol?
The IUPAC name of furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol (CID 57340430) is furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol?
The canonical SMILES for furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol is COc1ccc(C(O)(c2cccnc2)c2ccco2)cc1.
What is the InChIKey of furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol?
The InChIKey is ZHGPKFOAHZEJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-20-15-8-6-13(7-9-15)17(19,16-5-3-11-21-16)14-4-2-10-18-12-14/h2-12,19H,1H3.
What are the key properties of furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol?
furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol has a molecular weight of 281.31 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(4-methoxyphenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 57340430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).