[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone

C17H18FNO3 — CID 42844110

IUPAC[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCCC(OCc2ccc(F)cc2)C1
InChIInChI=1S/C17H18FNO3/c18-14-7-5-13(6-8-14)12-22-15-3-1-9-19(11-15)17(20)16-4-2-10-21-16/h2,4-8,10,15H,1,3,9,11-12H2
InChIKeyGOHYFBFWDBABBX-UHFFFAOYSA-N
MW303.33 g/mol
LogP3.24
Rot. Bonds4

About [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone

[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone (PubChem CID 42844110) has the molecular formula C17H18FNO3 and a molecular weight of 303.33 g/mol. Its IUPAC name is [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone
PubChem CID42844110
Molecular FormulaC17H18FNO3
Molecular Weight303.33 g/mol
Exact Mass303.13
IUPAC Name[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCCC(OCc2ccc(F)cc2)C1
InChIInChI=1S/C17H18FNO3/c18-14-7-5-13(6-8-14)12-22-15-3-1-9-19(11-15)17(20)16-4-2-10-21-16/h2,4-8,10,15H,1,3,9,11-12H2
InChIKeyGOHYFBFWDBABBX-UHFFFAOYSA-N
XLogP3.24
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2-fluorophenyl)-[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]methanone
CID 42844111
cyclopentyl-[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]methanone
CID 46153645
furan-2-yl-(3-phenoxypiperidin-1-yl)methanone
CID 110605371
[(3R)-3-[(R)-(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-(furan-2-yl)methanone
CID 126469323
(3-chloropiperidin-1-yl)-(furan-2-yl)methanone
CID 63392823
[3-[(3-fluorophenyl)methoxy]piperidin-1-yl]-(4-methylphenyl)methanone
CID 42844148
furan-2-yl-[3-(3-phenylpropoxy)pyrrolidin-1-yl]methanone
CID 71860926
1-(furan-2-carbonyl)-N-phenylmethoxypiperidine-3-carboxamide
CID 47019403
[(3S)-3-[(2,5-difluorophenyl)methoxy]piperidin-1-yl]-(4-fluorophenyl)methanone
CID 93223806
[2-[(4-fluorophenyl)methoxy]phenyl]-(3-hydroxypiperidin-1-yl)methanone
CID 110878351
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-(furan-2-carbonyl)piperidine-4-carboxamide
CID 17477799
furan-2-yl-[(3S)-3-phenylpiperidin-1-yl]methanone
CID 740547

Frequently Asked Questions

What is the IUPAC name of [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone (CID 42844110) is [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1CCCC(OCc2ccc(F)cc2)C1.
What is the InChIKey of [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone?
The InChIKey is GOHYFBFWDBABBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO3/c18-14-7-5-13(6-8-14)12-22-15-3-1-9-19(11-15)17(20)16-4-2-10-21-16/h2,4-8,10,15H,1,3,9,11-12H2.
What are the key properties of [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone?
[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone has a molecular weight of 303.33 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 42844110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).