7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine

C22H20N2O5 — CID 66779809

IUPAC7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine
SMILESCOc1cc(-c2ccnc3cc(-c4cc(OC)c(OC)c(OC)c4)oc23)ccn1
InChIInChI=1S/C22H20N2O5/c1-25-18-9-14(10-19(26-2)22(18)28-4)17-12-16-21(29-17)15(6-8-23-16)13-5-7-24-20(11-13)27-3/h5-12H,1-4H3
InChIKeyAGIULHUMRNUPPL-UHFFFAOYSA-N
MW392.41 g/mol
LogP4.59
Rot. Bonds6

About 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine

7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine (PubChem CID 66779809) has the molecular formula C22H20N2O5 and a molecular weight of 392.41 g/mol. Its IUPAC name is 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine.

Molecular Properties

Compound Name7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine
PubChem CID66779809
Molecular FormulaC22H20N2O5
Molecular Weight392.41 g/mol
Exact Mass392.14
IUPAC Name7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine
SMILESCOc1cc(-c2ccnc3cc(-c4cc(OC)c(OC)c(OC)c4)oc23)ccn1
InChIInChI=1S/C22H20N2O5/c1-25-18-9-14(10-19(26-2)22(18)28-4)17-12-16-21(29-17)15(6-8-23-16)13-5-7-24-20(11-13)27-3/h5-12H,1-4H3
InChIKeyAGIULHUMRNUPPL-UHFFFAOYSA-N
XLogP4.59
TPSA75.84 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.41
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine?
The IUPAC name of 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine (CID 66779809) is 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine.
What is the SMILES notation for 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine?
The canonical SMILES for 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine is COc1cc(-c2ccnc3cc(-c4cc(OC)c(OC)c(OC)c4)oc23)ccn1.
What is the InChIKey of 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine?
The InChIKey is AGIULHUMRNUPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O5/c1-25-18-9-14(10-19(26-2)22(18)28-4)17-12-16-21(29-17)15(6-8-23-16)13-5-7-24-20(11-13)27-3/h5-12H,1-4H3.
What are the key properties of 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine?
7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine has a molecular weight of 392.41 g/mol, XLogP of 4.59, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxy-4-pyridinyl)-2-(3,4,5-trimethoxyphenyl)furo[3,2-b]pyridine is sourced from PubChem (CID 66779809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).