6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine

C24H23N3O — CID 171471526

IUPAC6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine
SMILESCN1CCN(c2ccc(-c3cnc4c(-c5ccccc5)coc4c3)cc2)CC1
InChIInChI=1S/C24H23N3O/c1-26-11-13-27(14-12-26)21-9-7-18(8-10-21)20-15-23-24(25-16-20)22(17-28-23)19-5-3-2-4-6-19/h2-10,15-17H,11-14H2,1H3
InChIKeyCAEPODZCEXUPGK-UHFFFAOYSA-N
MW369.47 g/mol
LogP4.91
Rot. Bonds3

About 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine

6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine (PubChem CID 171471526) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine.

Molecular Properties

Compound Name6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine
PubChem CID171471526
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC Name6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine
SMILESCN1CCN(c2ccc(-c3cnc4c(-c5ccccc5)coc4c3)cc2)CC1
InChIInChI=1S/C24H23N3O/c1-26-11-13-27(14-12-26)21-9-7-18(8-10-21)20-15-23-24(25-16-20)22(17-28-23)19-5-3-2-4-6-19/h2-10,15-17H,11-14H2,1H3
InChIKeyCAEPODZCEXUPGK-UHFFFAOYSA-N
XLogP4.91
TPSA32.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine?
The IUPAC name of 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine (CID 171471526) is 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine.
What is the SMILES notation for 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine?
The canonical SMILES for 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine is CN1CCN(c2ccc(-c3cnc4c(-c5ccccc5)coc4c3)cc2)CC1.
What is the InChIKey of 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine?
The InChIKey is CAEPODZCEXUPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-26-11-13-27(14-12-26)21-9-7-18(8-10-21)20-15-23-24(25-16-20)22(17-28-23)19-5-3-2-4-6-19/h2-10,15-17H,11-14H2,1H3.
What are the key properties of 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine?
6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine has a molecular weight of 369.47 g/mol, XLogP of 4.91, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenylfuro[3,2-b]pyridine is sourced from PubChem (CID 171471526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).