4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine

C16H20FN3O — CID 131950223

IUPAC4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine
SMILESFc1ccc(OC2CCN(CCc3ncc[nH]3)CC2)cc1
InChIInChI=1S/C16H20FN3O/c17-13-1-3-14(4-2-13)21-15-5-10-20(11-6-15)12-7-16-18-8-9-19-16/h1-4,8-9,15H,5-7,10-12H2,(H,18,19)
InChIKeyBMCDYFRXQWALSS-UHFFFAOYSA-N
MW289.35 g/mol
LogP2.63
Rot. Bonds5

About 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine

4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine (PubChem CID 131950223) has the molecular formula C16H20FN3O and a molecular weight of 289.35 g/mol. Its IUPAC name is 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine
PubChem CID131950223
Molecular FormulaC16H20FN3O
Molecular Weight289.35 g/mol
Exact Mass289.16
IUPAC Name4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine
SMILESFc1ccc(OC2CCN(CCc3ncc[nH]3)CC2)cc1
InChIInChI=1S/C16H20FN3O/c17-13-1-3-14(4-2-13)21-15-5-10-20(11-6-15)12-7-16-18-8-9-19-16/h1-4,8-9,15H,5-7,10-12H2,(H,18,19)
InChIKeyBMCDYFRXQWALSS-UHFFFAOYSA-N
XLogP2.63
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[1-[2-(1H-imidazol-2-yl)ethyl]piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 72874168
3-[4-(4-fluorophenoxy)piperidin-1-yl]propan-1-ol
CID 111381858
1-(2-cyclohexylethyl)-4-(4-fluorophenoxy)piperidine
CID 174665920
4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
CID 167746466
4-(2-chlorophenoxy)-1-(1H-imidazol-2-ylmethyl)piperidine
CID 56902522
7-[2-[4-(4-fluorophenoxy)piperidin-1-yl]ethyl]-6,7-dihydro-5H-cyclopenta[c]pyridine
CID 134242981
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-[3-(1H-imidazol-2-yl)propyl]benzamide
CID 72886728
4-[4-[2-(1H-imidazol-2-yl)ethyl]piperazin-1-yl]phenol
CID 167971614
formic acid;1-[2-(1H-imidazol-2-yl)ethyl]piperidine
CID 157155381
but-2-enedioic acid;2-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propylamino]pyrimidine-4-carboxamide
CID 67876937
5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile
CID 10193950
1-[4-(4-fluorophenoxy)piperidin-1-yl]-3-phenoxypropan-2-ol
CID 141041914

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine?
The IUPAC name of 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine (CID 131950223) is 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine.
What is the SMILES notation for 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine?
The canonical SMILES for 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine is Fc1ccc(OC2CCN(CCc3ncc[nH]3)CC2)cc1.
What is the InChIKey of 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine?
The InChIKey is BMCDYFRXQWALSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3O/c17-13-1-3-14(4-2-13)21-15-5-10-20(11-6-15)12-7-16-18-8-9-19-16/h1-4,8-9,15H,5-7,10-12H2,(H,18,19).
What are the key properties of 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine?
4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine has a molecular weight of 289.35 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine is sourced from PubChem (CID 131950223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).