2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine

C13H18FNO — CID 84789182

IUPAC2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine
SMILESCOc1cc(C2CCCCN2)c(F)cc1C
InChIInChI=1S/C13H18FNO/c1-9-7-11(14)10(8-13(9)16-2)12-5-3-4-6-15-12/h7-8,12,15H,3-6H2,1-2H3
InChIKeyCDHBCOFODZWFPQ-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.96
Rot. Bonds2

About 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine

2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine (PubChem CID 84789182) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine.

Molecular Properties

Compound Name2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine
PubChem CID84789182
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine
SMILESCOc1cc(C2CCCCN2)c(F)cc1C
InChIInChI=1S/C13H18FNO/c1-9-7-11(14)10(8-13(9)16-2)12-5-3-4-6-15-12/h7-8,12,15H,3-6H2,1-2H3
InChIKeyCDHBCOFODZWFPQ-UHFFFAOYSA-N
XLogP2.96
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-fluoro-5-methoxy-4-methylphenyl)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

2-(5-bromo-2-fluoro-4-methoxyphenyl)piperidine
CID 84814359
2-(5-chloro-2-fluoro-4-methoxyphenyl)piperidine
CID 84704156
2-(2,4,5-trimethoxyphenyl)azepane
CID 62543409
(2S)-2-(4-fluoro-2-methoxyphenyl)piperidine
CID 96773994
2-[4-(2-fluoropropan-2-yl)-2,5-dimethoxyphenyl]piperidine
CID 117451731
(2S)-2-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
CID 171194833
2-fluoro-4-methyl-5-piperidin-2-ylphenol
CID 84780709
2-[2-(1-fluoroethyl)-4,5-dimethoxyphenyl]piperidine
CID 117421939
2-(5-fluoro-3-methoxy-2-methylphenyl)pyrrolidine
CID 84677004
2-[2-(fluoromethyl)-4,5-dimethoxyphenyl]pyrrolidine
CID 84701267
2-(5-chloro-2-methoxyphenyl)azepane
CID 4015818
2-(2,5-dimethoxy-4-propan-2-ylphenyl)piperidine
CID 117413709

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine?
The IUPAC name of 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine (CID 84789182) is 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine.
What is the SMILES notation for 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine?
The canonical SMILES for 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine is COc1cc(C2CCCCN2)c(F)cc1C.
What is the InChIKey of 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine?
The InChIKey is CDHBCOFODZWFPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c1-9-7-11(14)10(8-13(9)16-2)12-5-3-4-6-15-12/h7-8,12,15H,3-6H2,1-2H3.
What are the key properties of 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine?
2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine has a molecular weight of 223.29 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-5-methoxy-4-methylphenyl)piperidine is sourced from PubChem (CID 84789182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).