furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone

C17H19NO3 — CID 110410357

IUPACfuran-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCC(COc2ccccc2)C1
InChIInChI=1S/C17H19NO3/c19-17(16-9-5-11-20-16)18-10-4-6-14(12-18)13-21-15-7-2-1-3-8-15/h1-3,5,7-9,11,14H,4,6,10,12-13H2
InChIKeyXLWGNJJTIFSKAW-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.21
Rot. Bonds4

About furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone

furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone (PubChem CID 110410357) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone
PubChem CID110410357
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Namefuran-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCC(COc2ccccc2)C1
InChIInChI=1S/C17H19NO3/c19-17(16-9-5-11-20-16)18-10-4-6-14(12-18)13-21-15-7-2-1-3-8-15/h1-3,5,7-9,11,14H,4,6,10,12-13H2
InChIKeyXLWGNJJTIFSKAW-UHFFFAOYSA-N
XLogP3.21
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

furan-2-yl-[3-[[4-[(4-phenylpiperidin-1-yl)methyl]phenoxy]methyl]piperidin-1-yl]methanone
CID 45207969
furan-2-yl-[(3S)-3-[[4-[(4-phenylpiperidin-1-yl)methyl]phenoxy]methyl]piperidin-1-yl]methanone
CID 42501418
[(3R)-3-[[3-[(4-benzylpiperidin-1-yl)methyl]phenoxy]methyl]piperidin-1-yl]-(furan-2-yl)methanone
CID 42500399
4-[[(3S)-1-(furan-2-carbonyl)piperidin-3-yl]methoxy]-N-propan-2-ylbenzamide
CID 95097972
ethyl 4-[[4-[[(3R)-1-(furan-2-carbonyl)piperidin-3-yl]methoxy]phenyl]methyl]piperazine-1-carboxylate
CID 26321044
ethyl 4-[[4-[[(3S)-1-(furan-2-carbonyl)piperidin-3-yl]methoxy]phenyl]methyl]piperazine-1-carboxylate
CID 26321048
furan-2-yl-(3-phenoxypiperidin-1-yl)methanone
CID 110605371
1-[3-(phenoxymethyl)piperidin-1-yl]-3-phenylpropan-1-one
CID 110638413
furan-2-yl-[(3S)-3-phenylpiperidin-1-yl]methanone
CID 740547
[3-(benzenesulfonylmethyl)furan-2-yl]-[3-(phenoxymethyl)piperidin-1-yl]methanone
CID 86971189
3-amino-1-[3-(phenoxymethyl)piperidin-1-yl]propan-1-one
CID 102560007
(3-fluorophenyl)-[3-(phenoxymethyl)piperidin-1-yl]methanone
CID 110638403

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone (CID 110410357) is furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone is O=C(c1ccco1)N1CCCC(COc2ccccc2)C1.
What is the InChIKey of furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone?
The InChIKey is XLWGNJJTIFSKAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c19-17(16-9-5-11-20-16)18-10-4-6-14(12-18)13-21-15-7-2-1-3-8-15/h1-3,5,7-9,11,14H,4,6,10,12-13H2.
What are the key properties of furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone?
furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone has a molecular weight of 285.34 g/mol, XLogP of 3.21, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 110410357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).