3-fluoro-5-methoxy-2-methylpiperidine

C7H14FNO — CID 164775489

IUPAC3-fluoro-5-methoxy-2-methylpiperidine
SMILESCOC1CNC(C)C(F)C1
InChIInChI=1S/C7H14FNO/c1-5-7(8)3-6(10-2)4-9-5/h5-7,9H,3-4H2,1-2H3
InChIKeyVXFSJOZILBOCJF-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.72
Rot. Bonds1

About 3-fluoro-5-methoxy-2-methylpiperidine

3-fluoro-5-methoxy-2-methylpiperidine (PubChem CID 164775489) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 3-fluoro-5-methoxy-2-methylpiperidine.

Molecular Properties

Compound Name3-fluoro-5-methoxy-2-methylpiperidine
PubChem CID164775489
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name3-fluoro-5-methoxy-2-methylpiperidine
SMILESCOC1CNC(C)C(F)C1
InChIInChI=1S/C7H14FNO/c1-5-7(8)3-6(10-2)4-9-5/h5-7,9H,3-4H2,1-2H3
InChIKeyVXFSJOZILBOCJF-UHFFFAOYSA-N
XLogP0.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-tert-butyl-3-fluoro-5-methoxypiperidine
CID 164775357
(2R,3R)-3-fluoro-2-methylazetidine
CID 135396219
[(2S)-4-methoxypyrrolidin-2-yl]methanol
CID 159031091
(4-methoxypyrrolidin-2-yl)methanamine
CID 61214968
(2S,4S)-4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 119057051
4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 122236424
(2S,4R)-2-[fluoro(diphenyl)methyl]-4-methoxypyrrolidine
CID 11471670
4-methoxypyrrolidine-2-carboxylic acid;hydrochloride
CID 77213691
methyl (2S,4S)-4-methoxypyrrolidine-2-carboxylate
CID 14036209
(2R,4R)-4-methoxypyrrolidine-2-carbothioamide
CID 87536382
2-[(2R,4S)-4-methoxypyrrolidin-2-yl]ethanol
CID 155821329
(2R,4S)-2-butyl-4-methoxypyrrolidine
CID 99994244

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-methoxy-2-methylpiperidine?
The IUPAC name of 3-fluoro-5-methoxy-2-methylpiperidine (CID 164775489) is 3-fluoro-5-methoxy-2-methylpiperidine.
What is the SMILES notation for 3-fluoro-5-methoxy-2-methylpiperidine?
The canonical SMILES for 3-fluoro-5-methoxy-2-methylpiperidine is COC1CNC(C)C(F)C1.
What is the InChIKey of 3-fluoro-5-methoxy-2-methylpiperidine?
The InChIKey is VXFSJOZILBOCJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-5-7(8)3-6(10-2)4-9-5/h5-7,9H,3-4H2,1-2H3.
What are the key properties of 3-fluoro-5-methoxy-2-methylpiperidine?
3-fluoro-5-methoxy-2-methylpiperidine has a molecular weight of 147.19 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-methoxy-2-methylpiperidine is sourced from PubChem (CID 164775489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).