2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine

C22H22N4O2 — CID 59243058

IUPAC2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESCC(C)Oc1cc(OCCc2ccccn2)cc(-c2nc3ncccc3[nH]2)c1
InChIInChI=1S/C22H22N4O2/c1-15(2)28-19-13-16(21-25-20-7-5-10-24-22(20)26-21)12-18(14-19)27-11-8-17-6-3-4-9-23-17/h3-7,9-10,12-15H,8,11H2,1-2H3,(H,24,25,26)
InChIKeyOYZFCIQNIUNTPG-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.43
Rot. Bonds7

About 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine

2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 59243058) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
PubChem CID59243058
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESCC(C)Oc1cc(OCCc2ccccn2)cc(-c2nc3ncccc3[nH]2)c1
InChIInChI=1S/C22H22N4O2/c1-15(2)28-19-13-16(21-25-20-7-5-10-24-22(20)26-21)12-18(14-19)27-11-8-17-6-3-4-9-23-17/h3-7,9-10,12-15H,8,11H2,1-2H3,(H,24,25,26)
InChIKeyOYZFCIQNIUNTPG-UHFFFAOYSA-N
XLogP4.43
TPSA72.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine (CID 59243058) is 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine is CC(C)Oc1cc(OCCc2ccccn2)cc(-c2nc3ncccc3[nH]2)c1.
What is the InChIKey of 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is OYZFCIQNIUNTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-15(2)28-19-13-16(21-25-20-7-5-10-24-22(20)26-21)12-18(14-19)27-11-8-17-6-3-4-9-23-17/h3-7,9-10,12-15H,8,11H2,1-2H3,(H,24,25,26).
What are the key properties of 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 374.44 g/mol, XLogP of 4.43, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-propan-2-yloxy-5-(2-pyridin-2-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 59243058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).