3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine

C14H10ClNO2 — CID 117175979

IUPAC3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine
SMILESClc1ccc2oc(COc3cccnc3)cc2c1
InChIInChI=1S/C14H10ClNO2/c15-11-3-4-14-10(6-11)7-13(18-14)9-17-12-2-1-5-16-8-12/h1-8H,9H2
InChIKeyXGAHRMKVFKPVPM-UHFFFAOYSA-N
MW259.69 g/mol
LogP4.06
Rot. Bonds3

About 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine

3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine (PubChem CID 117175979) has the molecular formula C14H10ClNO2 and a molecular weight of 259.69 g/mol. Its IUPAC name is 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine.

Molecular Properties

Compound Name3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine
PubChem CID117175979
Molecular FormulaC14H10ClNO2
Molecular Weight259.69 g/mol
Exact Mass259.04
IUPAC Name3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine
SMILESClc1ccc2oc(COc3cccnc3)cc2c1
InChIInChI=1S/C14H10ClNO2/c15-11-3-4-14-10(6-11)7-13(18-14)9-17-12-2-1-5-16-8-12/h1-8H,9H2
InChIKeyXGAHRMKVFKPVPM-UHFFFAOYSA-N
XLogP4.06
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.69
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-[(3-methylphenoxy)methyl]-1-benzofuran
CID 117175928
3-[(6-bromo-1-benzofuran-2-yl)methoxy]pyridine
CID 117179394
3-[(4-fluoro-1-benzofuran-2-yl)methoxy]pyridine
CID 117172370
6-chloro-2-(phenoxymethyl)-1-benzofuran
CID 117179310
2-(pyridin-3-yloxymethyl)-1-benzofuran-7-ol
CID 117182846
6-chloro-2-[(3-chlorophenoxy)methyl]-1-benzofuran
CID 117179353
2-(pyridin-3-yloxymethyl)-1-benzofuran-4-carboxylic acid
CID 117172450
[2-methyl-5-(pyridin-3-yloxymethyl)furan-3-yl]methanamine
CID 62449563
6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran
CID 117179379
[7-[(5-chloro-1-benzofuran-2-yl)methoxy]-4-methylchromen-2-ylidene]oxidanium
CID 163451349
3-[(6-chloro-1-benzothiophen-3-yl)methoxy]pyridine
CID 117178145
5-chloro-1-methyl-3-(pyridin-3-yloxymethyl)indole
CID 117175188

Frequently Asked Questions

What is the IUPAC name of 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine?
The IUPAC name of 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine (CID 117175979) is 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine.
What is the SMILES notation for 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine?
The canonical SMILES for 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine is Clc1ccc2oc(COc3cccnc3)cc2c1.
What is the InChIKey of 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine?
The InChIKey is XGAHRMKVFKPVPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClNO2/c15-11-3-4-14-10(6-11)7-13(18-14)9-17-12-2-1-5-16-8-12/h1-8H,9H2.
What are the key properties of 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine?
3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine has a molecular weight of 259.69 g/mol, XLogP of 4.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine is sourced from PubChem (CID 117175979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).