6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine

C18H13F2N5O2 — CID 53250634

IUPAC6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine
SMILESCOc1ccc(-n2c(-c3ccccn3)nc3cc(OC(F)F)cnc32)cn1
InChIInChI=1S/C18H13F2N5O2/c1-26-15-6-5-11(9-22-15)25-16-14(8-12(10-23-16)27-18(19)20)24-17(25)13-4-2-3-7-21-13/h2-10,18H,1H3
InChIKeyCTMIDOCXGPSLOS-UHFFFAOYSA-N
MW369.33 g/mol
LogP3.49
Rot. Bonds5

About 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine

6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine (PubChem CID 53250634) has the molecular formula C18H13F2N5O2 and a molecular weight of 369.33 g/mol. Its IUPAC name is 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine
PubChem CID53250634
Molecular FormulaC18H13F2N5O2
Molecular Weight369.33 g/mol
Exact Mass369.10
IUPAC Name6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine
SMILESCOc1ccc(-n2c(-c3ccccn3)nc3cc(OC(F)F)cnc32)cn1
InChIInChI=1S/C18H13F2N5O2/c1-26-15-6-5-11(9-22-15)25-16-14(8-12(10-23-16)27-18(19)20)24-17(25)13-4-2-3-7-21-13/h2-10,18H,1H3
InChIKeyCTMIDOCXGPSLOS-UHFFFAOYSA-N
XLogP3.49
TPSA74.95 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.33
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine?
The IUPAC name of 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine (CID 53250634) is 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine is COc1ccc(-n2c(-c3ccccn3)nc3cc(OC(F)F)cnc32)cn1.
What is the InChIKey of 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine?
The InChIKey is CTMIDOCXGPSLOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F2N5O2/c1-26-15-6-5-11(9-22-15)25-16-14(8-12(10-23-16)27-18(19)20)24-17(25)13-4-2-3-7-21-13/h2-10,18H,1H3.
What are the key properties of 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine?
6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine has a molecular weight of 369.33 g/mol, XLogP of 3.49, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-3-(6-methoxy-3-pyridinyl)-2-pyridin-2-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 53250634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).