6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine

C22H26ClN5O2 — CID 176679261

IUPAC6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine
SMILESCOc1nc(C2CCN(C)CC2)ccc1-c1nc2nc(OC3CCC3)[nH]c2cc1Cl
InChIInChI=1S/C22H26ClN5O2/c1-28-10-8-13(9-11-28)17-7-6-15(21(24-17)29-2)19-16(23)12-18-20(26-19)27-22(25-18)30-14-4-3-5-14/h6-7,12-14H,3-5,8-11H2,1-2H3,(H,25,26,27)
InChIKeyVCBZBOOGWPMMEN-UHFFFAOYSA-N
MW427.94 g/mol
LogP4.42
Rot. Bonds5

About 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine

6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 176679261) has the molecular formula C22H26ClN5O2 and a molecular weight of 427.94 g/mol. Its IUPAC name is 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine
PubChem CID176679261
Molecular FormulaC22H26ClN5O2
Molecular Weight427.94 g/mol
Exact Mass427.18
IUPAC Name6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine
SMILESCOc1nc(C2CCN(C)CC2)ccc1-c1nc2nc(OC3CCC3)[nH]c2cc1Cl
InChIInChI=1S/C22H26ClN5O2/c1-28-10-8-13(9-11-28)17-7-6-15(21(24-17)29-2)19-16(23)12-18-20(26-19)27-22(25-18)30-14-4-3-5-14/h6-7,12-14H,3-5,8-11H2,1-2H3,(H,25,26,27)
InChIKeyVCBZBOOGWPMMEN-UHFFFAOYSA-N
XLogP4.42
TPSA76.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.94
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine (CID 176679261) is 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine is COc1nc(C2CCN(C)CC2)ccc1-c1nc2nc(OC3CCC3)[nH]c2cc1Cl.
What is the InChIKey of 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is VCBZBOOGWPMMEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26ClN5O2/c1-28-10-8-13(9-11-28)17-7-6-15(21(24-17)29-2)19-16(23)12-18-20(26-19)27-22(25-18)30-14-4-3-5-14/h6-7,12-14H,3-5,8-11H2,1-2H3,(H,25,26,27).
What are the key properties of 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine?
6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 427.94 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclobutyloxy-5-[2-methoxy-6-(1-methylpiperidin-4-yl)-3-pyridinyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 176679261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).