3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine

C15H12INO3 — CID 59200646

IUPAC3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine
SMILESCOc1ccc(-c2oc3cc(OC)cnc3c2I)cc1
InChIInChI=1S/C15H12INO3/c1-18-10-5-3-9(4-6-10)15-13(16)14-12(20-15)7-11(19-2)8-17-14/h3-8H,1-2H3
InChIKeyLAHPCXYWAGMXQG-UHFFFAOYSA-N
MW381.17 g/mol
LogP4.12
Rot. Bonds3

About 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine

3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine (PubChem CID 59200646) has the molecular formula C15H12INO3 and a molecular weight of 381.17 g/mol. Its IUPAC name is 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine.

Molecular Properties

Compound Name3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine
PubChem CID59200646
Molecular FormulaC15H12INO3
Molecular Weight381.17 g/mol
Exact Mass380.99
IUPAC Name3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine
SMILESCOc1ccc(-c2oc3cc(OC)cnc3c2I)cc1
InChIInChI=1S/C15H12INO3/c1-18-10-5-3-9(4-6-10)15-13(16)14-12(20-15)7-11(19-2)8-17-14/h3-8H,1-2H3
InChIKeyLAHPCXYWAGMXQG-UHFFFAOYSA-N
XLogP4.12
TPSA44.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.17
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3-iodo-6-methoxy-2-(1-methylpyrazol-4-yl)furo[3,2-b]pyridine
CID 59200635
3-iodo-6-methoxy-2-(4-methoxyphenyl)-1-benzofuran
CID 50943995
3,8-dimethoxy-1,10-phenanthroline
CID 11390810
3-methoxy-7-methyl-[1]benzofuro[3,2-b]pyridine
CID 177207014
2,3-bis(4-methoxyphenyl)furo[3,2-b]pyridine
CID 25011587
3-methoxy-8-methylisochromeno[4,3-b]pyridin-6-one
CID 167663655
3-bromo-5-methoxy-2-(4-methoxyphenyl)-1-benzofuran
CID 89479970
3-hydroxy-6-iodo-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
CID 171355593
3-(4-bromobutoxy)-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
CID 171061266
3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran
CID 71608239
3,6-dimethoxy-2-(4-methoxyphenyl)chromen-4-one
CID 14804651
3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-5-methyl-1-benzofuran
CID 141261100

Frequently Asked Questions

What is the IUPAC name of 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine?
The IUPAC name of 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine (CID 59200646) is 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine.
What is the SMILES notation for 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine?
The canonical SMILES for 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine is COc1ccc(-c2oc3cc(OC)cnc3c2I)cc1.
What is the InChIKey of 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine?
The InChIKey is LAHPCXYWAGMXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12INO3/c1-18-10-5-3-9(4-6-10)15-13(16)14-12(20-15)7-11(19-2)8-17-14/h3-8H,1-2H3.
What are the key properties of 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine?
3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine has a molecular weight of 381.17 g/mol, XLogP of 4.12, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-6-methoxy-2-(4-methoxyphenyl)furo[3,2-b]pyridine is sourced from PubChem (CID 59200646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).