3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine

C16H17NO3 — CID 117431014

IUPAC3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine
SMILESCOc1c2ccoc2c(C2CCCNC2)c2ccoc12
InChIInChI=1S/C16H17NO3/c1-18-15-12-5-8-19-14(12)13(10-3-2-6-17-9-10)11-4-7-20-16(11)15/h4-5,7-8,10,17H,2-3,6,9H2,1H3
InChIKeyRPFKRQCGMLKWFU-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.65
Rot. Bonds2

About 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine

3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine (PubChem CID 117431014) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine.

Molecular Properties

Compound Name3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine
PubChem CID117431014
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine
SMILESCOc1c2ccoc2c(C2CCCNC2)c2ccoc12
InChIInChI=1S/C16H17NO3/c1-18-15-12-5-8-19-14(12)13(10-3-2-6-17-9-10)11-4-7-20-16(11)15/h4-5,7-8,10,17H,2-3,6,9H2,1H3
InChIKeyRPFKRQCGMLKWFU-UHFFFAOYSA-N
XLogP3.65
TPSA47.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine?
The IUPAC name of 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine (CID 117431014) is 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine.
What is the SMILES notation for 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine?
The canonical SMILES for 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine is COc1c2ccoc2c(C2CCCNC2)c2ccoc12.
What is the InChIKey of 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine?
The InChIKey is RPFKRQCGMLKWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-18-15-12-5-8-19-14(12)13(10-3-2-6-17-9-10)11-4-7-20-16(11)15/h4-5,7-8,10,17H,2-3,6,9H2,1H3.
What are the key properties of 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine?
3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine has a molecular weight of 271.32 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)piperidine is sourced from PubChem (CID 117431014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).