4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide

C23H25N3O3 — CID 42197892

IUPAC4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1ccc(OC2CCN(Cc3ccco3)CC2)cc1
InChIInChI=1S/C23H25N3O3/c27-23(25-16-19-4-1-2-12-24-19)18-6-8-20(9-7-18)29-21-10-13-26(14-11-21)17-22-5-3-15-28-22/h1-9,12,15,21H,10-11,13-14,16-17H2,(H,25,27)
InChIKeyMOYMUDBYPCXTPX-UHFFFAOYSA-N
MW391.47 g/mol
LogP3.65
Rot. Bonds7

About 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide

4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 42197892) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide
PubChem CID42197892
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1ccc(OC2CCN(Cc3ccco3)CC2)cc1
InChIInChI=1S/C23H25N3O3/c27-23(25-16-19-4-1-2-12-24-19)18-6-8-20(9-7-18)29-21-10-13-26(14-11-21)17-22-5-3-15-28-22/h1-9,12,15,21H,10-11,13-14,16-17H2,(H,25,27)
InChIKeyMOYMUDBYPCXTPX-UHFFFAOYSA-N
XLogP3.65
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide (CID 42197892) is 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide is O=C(NCc1ccccn1)c1ccc(OC2CCN(Cc3ccco3)CC2)cc1.
What is the InChIKey of 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is MOYMUDBYPCXTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c27-23(25-16-19-4-1-2-12-24-19)18-6-8-20(9-7-18)29-21-10-13-26(14-11-21)17-22-5-3-15-28-22/h1-9,12,15,21H,10-11,13-14,16-17H2,(H,25,27).
What are the key properties of 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide?
4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 391.47 g/mol, XLogP of 3.65, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(furan-2-ylmethyl)piperidin-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 42197892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).