1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine

C14H20FNO — CID 136545800

IUPAC1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine
SMILESCOCC1CCCCN1Cc1cccc(F)c1
InChIInChI=1S/C14H20FNO/c1-17-11-14-7-2-3-8-16(14)10-12-5-4-6-13(15)9-12/h4-6,9,14H,2-3,7-8,10-11H2,1H3
InChIKeyXZFPEPHACYJFGE-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.83
Rot. Bonds4

About 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine

1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine (PubChem CID 136545800) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine.

Molecular Properties

Compound Name1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine
PubChem CID136545800
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine
SMILESCOCC1CCCCN1Cc1cccc(F)c1
InChIInChI=1S/C14H20FNO/c1-17-11-14-7-2-3-8-16(14)10-12-5-4-6-13(15)9-12/h4-6,9,14H,2-3,7-8,10-11H2,1H3
InChIKeyXZFPEPHACYJFGE-UHFFFAOYSA-N
XLogP2.83
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)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-[(3-fluorophenyl)methyl]-5-[[2-(methoxymethyl)piperidin-1-yl]methyl]-1,2,4-oxadiazole
CID 45202615
3-[1-[(3-fluorophenyl)methyl]piperidin-2-yl]propanoic acid
CID 62217691
1-[1-[(3-fluorophenyl)methyl]piperidin-2-yl]ethanamine
CID 63254271
2-[1-[(3-fluorophenyl)methyl]piperidin-2-yl]cyclopentan-1-ol
CID 114340133
ethyl (2R)-1-[(3-fluorophenyl)methyl]piperidine-2-carboxylate
CID 765373
2-(chloromethyl)-1-[(3-methoxyphenyl)methyl]piperidine
CID 63386922
1-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrrolidine
CID 20895836
(3aR,8aR)-4-[(3-fluorophenyl)methyl]-2,3,3a,5,6,7,8,8a-octahydro-1H-pyrrolo[3,2-b]azepine
CID 178143551
1-[1-[(3-methoxyphenyl)methyl]piperidin-2-yl]-N-methylmethanamine
CID 55138843
1-[(3-fluorophenyl)methyl]-2-(1-methylpyrazol-3-yl)azepane
CID 46952888
5-[(2S)-1-[(3-fluorophenyl)methyl]azepan-2-yl]-3-methyl-1,2-oxazole
CID 51584498
[2-[[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]methyl]phenyl]boronic acid
CID 71150761

Frequently Asked Questions

What is the IUPAC name of 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine?
The IUPAC name of 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine (CID 136545800) is 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine.
What is the SMILES notation for 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine?
The canonical SMILES for 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine is COCC1CCCCN1Cc1cccc(F)c1.
What is the InChIKey of 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine?
The InChIKey is XZFPEPHACYJFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-17-11-14-7-2-3-8-16(14)10-12-5-4-6-13(15)9-12/h4-6,9,14H,2-3,7-8,10-11H2,1H3.
What are the key properties of 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine?
1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine has a molecular weight of 237.32 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-fluorophenyl)methyl]-2-(methoxymethyl)piperidine is sourced from PubChem (CID 136545800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).