4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine

C16H20FN3O — CID 167746466

IUPAC4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
SMILESCc1ncc(CN2CCC(Oc3ccc(F)cc3)CC2)[nH]1
InChIInChI=1S/C16H20FN3O/c1-12-18-10-14(19-12)11-20-8-6-16(7-9-20)21-15-4-2-13(17)3-5-15/h2-5,10,16H,6-9,11H2,1H3,(H,18,19)
InChIKeyLIHWSUNZHAMLGM-UHFFFAOYSA-N
MW289.35 g/mol
LogP2.90
Rot. Bonds4

About 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine

4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine (PubChem CID 167746466) has the molecular formula C16H20FN3O and a molecular weight of 289.35 g/mol. Its IUPAC name is 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine.

Molecular Properties

Compound Name4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
PubChem CID167746466
Molecular FormulaC16H20FN3O
Molecular Weight289.35 g/mol
Exact Mass289.16
IUPAC Name4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
SMILESCc1ncc(CN2CCC(Oc3ccc(F)cc3)CC2)[nH]1
InChIInChI=1S/C16H20FN3O/c1-12-18-10-14(19-12)11-20-8-6-16(7-9-20)21-15-4-2-13(17)3-5-15/h2-5,10,16H,6-9,11H2,1H3,(H,18,19)
InChIKeyLIHWSUNZHAMLGM-UHFFFAOYSA-N
XLogP2.90
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine 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

N-methyl-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-4-amine
CID 126578124
3-[2-(2,4-difluorophenyl)ethyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine
CID 45195941
4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine
CID 131950223
2-(4-fluorophenyl)-N-[[(3S)-1-[(2-methyl-1H-imidazol-5-yl)methyl]pyrrolidin-3-yl]methyl]acetamide
CID 95199379
3-[4-(4-fluorophenoxy)piperidin-1-yl]propan-1-ol
CID 111381858
1-ethylsulfonyl-4-(4-fluorophenoxy)piperidine
CID 110396981
(4S,5S)-5-(4-fluorophenoxy)-1-[(6-methyl-3-pyridinyl)methyl]azepan-4-ol
CID 110128684
4-[[4-(4-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 90245740
1-(2-cyclohexylethyl)-4-(4-fluorophenoxy)piperidine
CID 174665920
5-[[4-(4-methylphenoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120898672
2-(2-chloro-6-fluorophenyl)-N-[[1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-4-yl]methyl]acetamide
CID 131924794
6-[4-(4-fluorophenoxy)piperidin-1-yl]-2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CID 142496539

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
The IUPAC name of 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine (CID 167746466) is 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine.
What is the SMILES notation for 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
The canonical SMILES for 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine is Cc1ncc(CN2CCC(Oc3ccc(F)cc3)CC2)[nH]1.
What is the InChIKey of 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
The InChIKey is LIHWSUNZHAMLGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3O/c1-12-18-10-14(19-12)11-20-8-6-16(7-9-20)21-15-4-2-13(17)3-5-15/h2-5,10,16H,6-9,11H2,1H3,(H,18,19).
What are the key properties of 4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine?
4-(4-fluorophenoxy)-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine has a molecular weight of 289.35 g/mol, XLogP of 2.90, 4 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-methyl-1H-imidazol-5-yl)methyl]piperidine is sourced from PubChem (CID 167746466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).