2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol

C14H11NO3 — CID 117182846

IUPAC2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol
SMILESOc1cccc2cc(COc3cccnc3)oc12
InChIInChI=1S/C14H11NO3/c16-13-5-1-3-10-7-12(18-14(10)13)9-17-11-4-2-6-15-8-11/h1-8,16H,9H2
InChIKeyPOFPPMGFTZTBDG-UHFFFAOYSA-N
MW241.25 g/mol
LogP3.11
Rot. Bonds3

About 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol

2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol (PubChem CID 117182846) has the molecular formula C14H11NO3 and a molecular weight of 241.25 g/mol. Its IUPAC name is 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol.

Molecular Properties

Compound Name2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol
PubChem CID117182846
Molecular FormulaC14H11NO3
Molecular Weight241.25 g/mol
Exact Mass241.07
IUPAC Name2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol
SMILESOc1cccc2cc(COc3cccnc3)oc12
InChIInChI=1S/C14H11NO3/c16-13-5-1-3-10-7-12(18-14(10)13)9-17-11-4-2-6-15-8-11/h1-8,16H,9H2
InChIKeyPOFPPMGFTZTBDG-UHFFFAOYSA-N
XLogP3.11
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-bromophenoxy)methyl]-1-benzofuran-7-ol
CID 117182804
2-[(4-methylphenoxy)methyl]-1-benzofuran-7-ol
CID 117182822
3-[(6-bromo-1-benzofuran-2-yl)methoxy]pyridine
CID 117179394
2-(aminooxymethyl)-1-benzofuran-7-ol
CID 117197013
3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine
CID 117175979
3-[(4-fluoro-1-benzofuran-2-yl)methoxy]pyridine
CID 117172370
7-fluoro-2-(phenoxymethyl)-1-benzofuran
CID 117182764
2-(pyridin-3-yloxymethyl)-1-benzofuran-4-carboxylic acid
CID 117172450
4-(pyridin-3-yloxymethyl)benzene-1,3-diol
CID 117219782
[2-methyl-5-(pyridin-3-yloxymethyl)furan-3-yl]methanamine
CID 62449563
7-methyl-2-[(3-methylphenoxy)methyl]-1-benzofuran
CID 117186365
[2-(pyridin-3-yloxymethyl)-1-benzothiophen-7-yl]methanamine
CID 117183170

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol?
The IUPAC name of 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol (CID 117182846) is 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol.
What is the SMILES notation for 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol?
The canonical SMILES for 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol is Oc1cccc2cc(COc3cccnc3)oc12.
What is the InChIKey of 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol?
The InChIKey is POFPPMGFTZTBDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO3/c16-13-5-1-3-10-7-12(18-14(10)13)9-17-11-4-2-6-15-8-11/h1-8,16H,9H2.
What are the key properties of 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol?
2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol has a molecular weight of 241.25 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol is sourced from PubChem (CID 117182846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).