2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine

C24H29N3O — CID 90681212

IUPAC2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine
SMILESc1ccc(-c2cc3c(CN4CCC(N5CCCCC5)CC4)nccc3o2)cc1
InChIInChI=1S/C24H29N3O/c1-3-7-19(8-4-1)24-17-21-22(25-12-9-23(21)28-24)18-26-15-10-20(11-16-26)27-13-5-2-6-14-27/h1,3-4,7-9,12,17,20H,2,5-6,10-11,13-16,18H2
InChIKeyXXZJZLVRBDVGEZ-UHFFFAOYSA-N
MW375.52 g/mol
LogP4.95
Rot. Bonds4

About 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine

2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine (PubChem CID 90681212) has the molecular formula C24H29N3O and a molecular weight of 375.52 g/mol. Its IUPAC name is 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine.

Molecular Properties

Compound Name2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine
PubChem CID90681212
Molecular FormulaC24H29N3O
Molecular Weight375.52 g/mol
Exact Mass375.23
IUPAC Name2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine
SMILESc1ccc(-c2cc3c(CN4CCC(N5CCCCC5)CC4)nccc3o2)cc1
InChIInChI=1S/C24H29N3O/c1-3-7-19(8-4-1)24-17-21-22(25-12-9-23(21)28-24)18-26-15-10-20(11-16-26)27-13-5-2-6-14-27/h1,3-4,7-9,12,17,20H,2,5-6,10-11,13-16,18H2
InChIKeyXXZJZLVRBDVGEZ-UHFFFAOYSA-N
XLogP4.95
TPSA32.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.52
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine?
The IUPAC name of 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine (CID 90681212) is 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine.
What is the SMILES notation for 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine?
The canonical SMILES for 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine is c1ccc(-c2cc3c(CN4CCC(N5CCCCC5)CC4)nccc3o2)cc1.
What is the InChIKey of 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine?
The InChIKey is XXZJZLVRBDVGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O/c1-3-7-19(8-4-1)24-17-21-22(25-12-9-23(21)28-24)18-26-15-10-20(11-16-26)27-13-5-2-6-14-27/h1,3-4,7-9,12,17,20H,2,5-6,10-11,13-16,18H2.
What are the key properties of 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine?
2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine has a molecular weight of 375.52 g/mol, XLogP of 4.95, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]furo[3,2-c]pyridine is sourced from PubChem (CID 90681212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).