2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine

C14H20FNO — CID 106635068

IUPAC2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine
SMILESCOc1ccc(C(F)C2CCCCN2)c(C)c1
InChIInChI=1S/C14H20FNO/c1-10-9-11(17-2)6-7-12(10)14(15)13-5-3-4-8-16-13/h6-7,9,13-14,16H,3-5,8H2,1-2H3
InChIKeyOQIHDFNBQGJYSI-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.16
Rot. Bonds3

About 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine

2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine (PubChem CID 106635068) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine.

Molecular Properties

Compound Name2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine
PubChem CID106635068
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine
SMILESCOc1ccc(C(F)C2CCCCN2)c(C)c1
InChIInChI=1S/C14H20FNO/c1-10-9-11(17-2)6-7-12(10)14(15)13-5-3-4-8-16-13/h6-7,9,13-14,16H,3-5,8H2,1-2H3
InChIKeyOQIHDFNBQGJYSI-UHFFFAOYSA-N
XLogP3.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine
CID 106634961
(2S)-2-(4-methoxy-2-methylphenyl)azepane
CID 26189003
(3-methoxyphenyl)-[(2S)-piperidin-2-yl]methanol
CID 69187424
[2-methyl-4-(trifluoromethyl)phenyl]-piperidin-2-ylmethanol
CID 106634718
(2,5-dimethoxyphenyl)-pyrrolidin-2-ylmethanamine
CID 82291674
2-(2,4-dimethylphenyl)-2-piperidin-2-ylethanamine
CID 83986431
(2R)-2-(4-methoxy-2-methylphenyl)azetidine
CID 130623728
1-[(S)-cyclobutyl-(4-methoxy-2-methylphenyl)methyl]piperazine;dihydrochloride
CID 171282616
1-cycloheptyl-1-(4-methoxy-2-methylphenyl)-N-methylmethanamine
CID 55091680
(4-methoxy-2-methylphenyl)-piperidin-4-ylmethanol
CID 80560362
2-(2-bromo-4-methoxyphenyl)piperidine
CID 82625568
1-[(R)-cyclopropyl-(4-methoxy-2-methylphenyl)methyl]piperazine;dihydrochloride
CID 171295234

Frequently Asked Questions

What is the IUPAC name of 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine?
The IUPAC name of 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine (CID 106635068) is 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine.
What is the SMILES notation for 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine?
The canonical SMILES for 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine is COc1ccc(C(F)C2CCCCN2)c(C)c1.
What is the InChIKey of 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine?
The InChIKey is OQIHDFNBQGJYSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-10-9-11(17-2)6-7-12(10)14(15)13-5-3-4-8-16-13/h6-7,9,13-14,16H,3-5,8H2,1-2H3.
What are the key properties of 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine?
2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine has a molecular weight of 237.32 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine is sourced from PubChem (CID 106635068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).