furan-2-yl-(3-phenoxypiperidin-1-yl)methanone

C16H17NO3 — CID 110605371

IUPACfuran-2-yl-(3-phenoxypiperidin-1-yl)methanone
SMILESO=C(c1ccco1)N1CCCC(Oc2ccccc2)C1
InChIInChI=1S/C16H17NO3/c18-16(15-9-5-11-19-15)17-10-4-8-14(12-17)20-13-6-2-1-3-7-13/h1-3,5-7,9,11,14H,4,8,10,12H2
InChIKeyCAOOVCKCNLIXHA-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.96
Rot. Bonds3

About furan-2-yl-(3-phenoxypiperidin-1-yl)methanone

furan-2-yl-(3-phenoxypiperidin-1-yl)methanone (PubChem CID 110605371) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is furan-2-yl-(3-phenoxypiperidin-1-yl)methanone.

Molecular Properties

Compound Namefuran-2-yl-(3-phenoxypiperidin-1-yl)methanone
PubChem CID110605371
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Namefuran-2-yl-(3-phenoxypiperidin-1-yl)methanone
SMILESO=C(c1ccco1)N1CCCC(Oc2ccccc2)C1
InChIInChI=1S/C16H17NO3/c18-16(15-9-5-11-19-15)17-10-4-8-14(12-17)20-13-6-2-1-3-7-13/h1-3,5-7,9,11,14H,4,8,10,12H2
InChIKeyCAOOVCKCNLIXHA-UHFFFAOYSA-N
XLogP2.96
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

furan-2-yl-[(3R)-3-pyridin-4-yloxypyrrolidin-1-yl]methanone
CID 124725318
furan-2-yl-[3-(phenoxymethyl)piperidin-1-yl]methanone
CID 110410357
furan-2-yl-[(3S)-3-phenylpiperidin-1-yl]methanone
CID 740547
(3-chloropiperidin-1-yl)-(furan-2-yl)methanone
CID 63392823
furan-2-yl-(3-phenylazepan-1-yl)methanone
CID 90608497
[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone
CID 42844110
methyl 3-phenoxypiperidine-1-carboxylate
CID 110605413
(3-fluorophenyl)-(3-phenoxypiperidin-1-yl)methanone
CID 110605378
furan-2-yl-[3-(3-phenylpropoxy)pyrrolidin-1-yl]methanone
CID 71860926
1-(furan-2-carbonyl)-N-phenylmethoxypiperidine-3-carboxamide
CID 47019403
(3S)-1-(furan-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 94917226
1-(furan-2-carbonyl)piperidine-3,4-dicarboxylic acid
CID 112568035

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(3-phenoxypiperidin-1-yl)methanone?
The IUPAC name of furan-2-yl-(3-phenoxypiperidin-1-yl)methanone (CID 110605371) is furan-2-yl-(3-phenoxypiperidin-1-yl)methanone.
What is the SMILES notation for furan-2-yl-(3-phenoxypiperidin-1-yl)methanone?
The canonical SMILES for furan-2-yl-(3-phenoxypiperidin-1-yl)methanone is O=C(c1ccco1)N1CCCC(Oc2ccccc2)C1.
What is the InChIKey of furan-2-yl-(3-phenoxypiperidin-1-yl)methanone?
The InChIKey is CAOOVCKCNLIXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c18-16(15-9-5-11-19-15)17-10-4-8-14(12-17)20-13-6-2-1-3-7-13/h1-3,5-7,9,11,14H,4,8,10,12H2.
What are the key properties of furan-2-yl-(3-phenoxypiperidin-1-yl)methanone?
furan-2-yl-(3-phenoxypiperidin-1-yl)methanone has a molecular weight of 271.32 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(3-phenoxypiperidin-1-yl)methanone is sourced from PubChem (CID 110605371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).