piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone

C16H19NO3 — CID 113199930

IUPACpiperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone
SMILESO=C(c1c2c(cc3c1OCC3)OCC2)N1CCCCC1
InChIInChI=1S/C16H19NO3/c18-16(17-6-2-1-3-7-17)14-12-5-9-19-13(12)10-11-4-8-20-15(11)14/h10H,1-9H2
InChIKeyCGFMENJWVNLXBI-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.18
Rot. Bonds1

About piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone

piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone (PubChem CID 113199930) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone.

Molecular Properties

Compound Namepiperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone
PubChem CID113199930
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Namepiperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone
SMILESO=C(c1c2c(cc3c1OCC3)OCC2)N1CCCCC1
InChIInChI=1S/C16H19NO3/c18-16(17-6-2-1-3-7-17)14-12-5-9-19-13(12)10-11-4-8-20-15(11)14/h10H,1-9H2
InChIKeyCGFMENJWVNLXBI-UHFFFAOYSA-N
XLogP2.18
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-piperidin-1-ylphenyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-carboxamide
CID 113200077
2,3-dihydro-1-benzofuran-5-yl(pyrrolidin-1-yl)methanone
CID 60739558
N-phenyl-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-carboxamide
CID 113200012
3-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)propanoic acid
CID 115010687
N-(3,5-dichlorophenyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-carboxamide
CID 113200103
2,2-dimethyl-N-[2-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)ethyl]propanamide
CID 113095519
N-butyl-N-methyl-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-carboxamide
CID 113200003
1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)ethanone
CID 113199468
furan-2-yl-[4-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-ylmethyl)piperidin-1-yl]methanone
CID 113096179
3,4-dihydro-2H-chromen-6-yl(piperidin-1-yl)methanone
CID 110693318
ethyl 4-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-ylmethylcarbamoyl)piperazine-1-carboxylate
CID 113217766
1-[4-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-ylmethyl)piperidin-1-yl]propan-1-one
CID 113096169

Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone?
The IUPAC name of piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone (CID 113199930) is piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone.
What is the SMILES notation for piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone?
The canonical SMILES for piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone is O=C(c1c2c(cc3c1OCC3)OCC2)N1CCCCC1.
What is the InChIKey of piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone?
The InChIKey is CGFMENJWVNLXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c18-16(17-6-2-1-3-7-17)14-12-5-9-19-13(12)10-11-4-8-20-15(11)14/h10H,1-9H2.
What are the key properties of piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone?
piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone has a molecular weight of 273.33 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)methanone is sourced from PubChem (CID 113199930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).