2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine

C23H24N4O — CID 152617267

IUPAC2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccnc(CCc2nc3nccc(CCc4ccccc4C)c3[nH]2)c1
InChIInChI=1S/C23H24N4O/c1-16-5-3-4-6-17(16)7-8-18-11-13-25-23-22(18)26-21(27-23)10-9-19-15-20(28-2)12-14-24-19/h3-6,11-15H,7-10H2,1-2H3,(H,25,26,27)
InChIKeyZATWVBAWRVTMBQ-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.24
Rot. Bonds7

About 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine

2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 152617267) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine
PubChem CID152617267
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccnc(CCc2nc3nccc(CCc4ccccc4C)c3[nH]2)c1
InChIInChI=1S/C23H24N4O/c1-16-5-3-4-6-17(16)7-8-18-11-13-25-23-22(18)26-21(27-23)10-9-19-15-20(28-2)12-14-24-19/h3-6,11-15H,7-10H2,1-2H3,(H,25,26,27)
InChIKeyZATWVBAWRVTMBQ-UHFFFAOYSA-N
XLogP4.24
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine (CID 152617267) is 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine is COc1ccnc(CCc2nc3nccc(CCc4ccccc4C)c3[nH]2)c1.
What is the InChIKey of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is ZATWVBAWRVTMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c1-16-5-3-4-6-17(16)7-8-18-11-13-25-23-22(18)26-21(27-23)10-9-19-15-20(28-2)12-14-24-19/h3-6,11-15H,7-10H2,1-2H3,(H,25,26,27).
What are the key properties of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine?
2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 372.47 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 152617267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).