[4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone

C19H20FNO3 — CID 110396932

IUPAC[4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C19H20FNO3/c1-23-16-6-2-14(3-7-16)19(22)21-12-10-18(11-13-21)24-17-8-4-15(20)5-9-17/h2-9,18H,10-13H2,1H3
InChIKeyQTYCTYMEVRZBQQ-UHFFFAOYSA-N
MW329.37 g/mol
LogP3.52
Rot. Bonds4

About [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone

[4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone (PubChem CID 110396932) has the molecular formula C19H20FNO3 and a molecular weight of 329.37 g/mol. Its IUPAC name is [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone.

Molecular Properties

Compound Name[4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone
PubChem CID110396932
Molecular FormulaC19H20FNO3
Molecular Weight329.37 g/mol
Exact Mass329.14
IUPAC Name[4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C19H20FNO3/c1-23-16-6-2-14(3-7-16)19(22)21-12-10-18(11-13-21)24-17-8-4-15(20)5-9-17/h2-9,18H,10-13H2,1H3
InChIKeyQTYCTYMEVRZBQQ-UHFFFAOYSA-N
XLogP3.52
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.37
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(4-methoxyphenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone
CID 110396821
(4-bromophenyl)-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 44781860
(4-chlorophenyl)-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396841
[4-(4-fluorophenoxy)piperidin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 110396962
[4-(4-fluorobenzoyl)-1,4-diazepan-1-yl]-(4-methoxyphenyl)methanone
CID 38472427
[4-[bis(4-fluorophenyl)methyl]piperidin-1-yl]-(4-methoxyphenyl)methanone
CID 170231670
[4-(4-methoxyphenoxy)piperidin-1-yl]-(3-methoxyphenyl)methanone
CID 110396820
[4-(4-methoxyphenoxy)piperidin-1-yl]-(4-thiophen-3-ylphenyl)methanone
CID 166377497
[4-[4-(4-fluorophenoxy)piperidine-1-carbonyl]phenyl]methylurea
CID 119133486
(4-fluorophenyl)-[4-(1-methylpiperidin-4-yl)oxypiperidin-1-yl]methanone
CID 91916416
(4-fluorophenyl)-[3-(4-methoxyphenyl)-4-methylpiperidin-1-yl]methanone
CID 153340115
[6-[4-(4-fluorophenoxy)piperidin-1-yl]-3-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 133345853

Frequently Asked Questions

What is the IUPAC name of [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone?
The IUPAC name of [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone (CID 110396932) is [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone.
What is the SMILES notation for [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone?
The canonical SMILES for [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone is COc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3)CC2)cc1.
What is the InChIKey of [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone?
The InChIKey is QTYCTYMEVRZBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO3/c1-23-16-6-2-14(3-7-16)19(22)21-12-10-18(11-13-21)24-17-8-4-15(20)5-9-17/h2-9,18H,10-13H2,1H3.
What are the key properties of [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone?
[4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone has a molecular weight of 329.37 g/mol, XLogP of 3.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluorophenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone is sourced from PubChem (CID 110396932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).