2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine

C24H24N4O — CID 90368114

IUPAC2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine
SMILESc1ccc(COc2ccc(-c3nc4nc(C5CCNCC5)ccc4[nH]3)cc2)cc1
InChIInChI=1S/C24H24N4O/c1-2-4-17(5-3-1)16-29-20-8-6-19(7-9-20)23-27-22-11-10-21(26-24(22)28-23)18-12-14-25-15-13-18/h1-11,18,25H,12-16H2,(H,26,27,28)
InChIKeyOHAQCUFHVRUEPQ-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.67
Rot. Bonds5

About 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine

2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine (PubChem CID 90368114) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine
PubChem CID90368114
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine
SMILESc1ccc(COc2ccc(-c3nc4nc(C5CCNCC5)ccc4[nH]3)cc2)cc1
InChIInChI=1S/C24H24N4O/c1-2-4-17(5-3-1)16-29-20-8-6-19(7-9-20)23-27-22-11-10-21(26-24(22)28-23)18-12-14-25-15-13-18/h1-11,18,25H,12-16H2,(H,26,27,28)
InChIKeyOHAQCUFHVRUEPQ-UHFFFAOYSA-N
XLogP4.67
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine (CID 90368114) is 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine is c1ccc(COc2ccc(-c3nc4nc(C5CCNCC5)ccc4[nH]3)cc2)cc1.
What is the InChIKey of 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
The InChIKey is OHAQCUFHVRUEPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-2-4-17(5-3-1)16-29-20-8-6-19(7-9-20)23-27-22-11-10-21(26-24(22)28-23)18-12-14-25-15-13-18/h1-11,18,25H,12-16H2,(H,26,27,28).
What are the key properties of 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine?
2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine has a molecular weight of 384.48 g/mol, XLogP of 4.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylmethoxyphenyl)-5-piperidin-4-yl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 90368114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).