[3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone

C25H24FNO2 — CID 22127779

IUPAC[3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1cccc(COC2CNCCC2c2ccc(F)cc2)c1
InChIInChI=1S/C25H24FNO2/c26-22-11-9-19(10-12-22)23-13-14-27-16-24(23)29-17-18-5-4-8-21(15-18)25(28)20-6-2-1-3-7-20/h1-12,15,23-24,27H,13-14,16-17H2
InChIKeyRFUODSWMHSEIHH-UHFFFAOYSA-N
MW389.47 g/mol
LogP4.72
Rot. Bonds6

About [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone

[3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone (PubChem CID 22127779) has the molecular formula C25H24FNO2 and a molecular weight of 389.47 g/mol. Its IUPAC name is [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone
PubChem CID22127779
Molecular FormulaC25H24FNO2
Molecular Weight389.47 g/mol
Exact Mass389.18
IUPAC Name[3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1cccc(COC2CNCCC2c2ccc(F)cc2)c1
InChIInChI=1S/C25H24FNO2/c26-22-11-9-19(10-12-22)23-13-14-27-16-24(23)29-17-18-5-4-8-21(15-18)25(28)20-6-2-1-3-7-20/h1-12,15,23-24,27H,13-14,16-17H2
InChIKeyRFUODSWMHSEIHH-UHFFFAOYSA-N
XLogP4.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.47
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(3-benzoylphenyl)methoxy]-4-(4-fluorophenyl)piperidine-1-carboxylate
CID 22128638
tert-butyl 3-[(3-benzoylphenyl)methoxy]-4-(4-fluorophenyl)piperidine-1-carboxylate
CID 86604453
[3-[[(3R,4R)-4-dibenzofuran-4-ylpiperidin-3-yl]oxymethyl]phenyl]-phenylmethanone;hydrochloride
CID 67542015
6-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]naphthalen-2-ol
CID 22127989
2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]acetic acid
CID 22127042
4-(4-fluorophenyl)-3-[(8-methoxynaphthalen-2-yl)methoxy]piperidine
CID 22126755
(3R,4S)-4-(4-fluorophenyl)-3-[(4-phenylmethoxynaphthalen-2-yl)methoxy]piperidine
CID 10160522
4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]-N-(3-oxo-3-phenylpropyl)benzamide
CID 22126678
phenacyl 2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]acetate;2,2,2-trifluoroacetic acid
CID 159327738
4-(4-fluorophenyl)-3-[(6-methoxynaphthalen-2-yl)methoxy]piperidine
CID 22126304
4-(3-methylphenyl)-3-phenylmethoxypiperidine
CID 21193252
(3R,4R)-3-phenylmethoxy-4-(3-phenylphenyl)piperidine;hydrochloride
CID 67542732

Frequently Asked Questions

What is the IUPAC name of [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone?
The IUPAC name of [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone (CID 22127779) is [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone.
What is the SMILES notation for [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone?
The canonical SMILES for [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone is O=C(c1ccccc1)c1cccc(COC2CNCCC2c2ccc(F)cc2)c1.
What is the InChIKey of [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone?
The InChIKey is RFUODSWMHSEIHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FNO2/c26-22-11-9-19(10-12-22)23-13-14-27-16-24(23)29-17-18-5-4-8-21(15-18)25(28)20-6-2-1-3-7-20/h1-12,15,23-24,27H,13-14,16-17H2.
What are the key properties of [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone?
[3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone has a molecular weight of 389.47 g/mol, XLogP of 4.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[4-(4-fluorophenyl)piperidin-3-yl]oxymethyl]phenyl]-phenylmethanone is sourced from PubChem (CID 22127779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).