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

C14H20FNO — CID 67983211

IUPAC3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine
SMILESCOCC1(Cc2ccccc2F)CCCNC1
InChIInChI=1S/C14H20FNO/c1-17-11-14(7-4-8-16-10-14)9-12-5-2-3-6-13(12)15/h2-3,5-6,16H,4,7-11H2,1H3
InChIKeyJNAUADTVTXINQC-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.38
Rot. Bonds4

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

3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine (PubChem CID 67983211) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine
PubChem CID67983211
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine
SMILESCOCC1(Cc2ccccc2F)CCCNC1
InChIInChI=1S/C14H20FNO/c1-17-11-14(7-4-8-16-10-14)9-12-5-2-3-6-13(12)15/h2-3,5-6,16H,4,7-11H2,1H3
InChIKeyJNAUADTVTXINQC-UHFFFAOYSA-N
XLogP2.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-[(5-chloro-2-fluorophenyl)methyl]piperidin-3-yl]methanol
CID 103051183
N-[[1-[(2-fluorophenyl)methyl]cyclohexyl]methyl]ethanamine
CID 62726182
[3-[(2,4-difluorophenyl)methyl]piperidin-3-yl]methanol
CID 56753257
1-(2-fluorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]methanesulfonamide;hydrochloride
CID 120896382
[3-[(2,4-difluorophenyl)methyl]piperidin-3-yl]methanol;hydrochloride
CID 154892250
N-[(2-fluorophenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 55176835
3-benzyl-3-(fluoromethyl)piperidine
CID 84779719
[1-[(2-fluorophenyl)methyl]cyclopropyl]methanamine
CID 66024201
1-[(2-fluorophenyl)methyl]cyclooctan-1-amine
CID 80603906
1-[[1-(bromomethyl)cyclopentyl]methoxymethyl]-2-fluorobenzene
CID 65001094
2-(methoxymethyl)-2-[(2-methylphenyl)methyl]piperidine
CID 117272049
3-fluoro-3-(methoxymethyl)piperidine
CID 112562901

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine?
The IUPAC name of 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine (CID 67983211) is 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine.
What is the SMILES notation for 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine?
The canonical SMILES for 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine is COCC1(Cc2ccccc2F)CCCNC1.
What is the InChIKey of 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine?
The InChIKey is JNAUADTVTXINQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-17-11-14(7-4-8-16-10-14)9-12-5-2-3-6-13(12)15/h2-3,5-6,16H,4,7-11H2,1H3.
What are the key properties of 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine?
3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine has a molecular weight of 237.32 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine is sourced from PubChem (CID 67983211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).