3-fluoro-1-methylpyrrolidine;methoxymethane

C7H16FNO — CID 162743316

IUPAC3-fluoro-1-methylpyrrolidine;methoxymethane
SMILESCN1CCC(F)C1.COC
InChIInChI=1S/C5H10FN.C2H6O/c1-7-3-2-5(6)4-7;1-3-2/h5H,2-4H2,1H3;1-2H3
InChIKeyIOTWXTPODVCWPP-UHFFFAOYSA-N
MW149.21 g/mol
LogP0.92
Rot. Bonds

About 3-fluoro-1-methylpyrrolidine;methoxymethane

3-fluoro-1-methylpyrrolidine;methoxymethane (PubChem CID 162743316) has the molecular formula C7H16FNO and a molecular weight of 149.21 g/mol. Its IUPAC name is 3-fluoro-1-methylpyrrolidine;methoxymethane.

Molecular Properties

Compound Name3-fluoro-1-methylpyrrolidine;methoxymethane
PubChem CID162743316
Molecular FormulaC7H16FNO
Molecular Weight149.21 g/mol
Exact Mass149.12
IUPAC Name3-fluoro-1-methylpyrrolidine;methoxymethane
SMILESCN1CCC(F)C1.COC
InChIInChI=1S/C5H10FN.C2H6O/c1-7-3-2-5(6)4-7;1-3-2/h5H,2-4H2,1H3;1-2H3
InChIKeyIOTWXTPODVCWPP-UHFFFAOYSA-N
XLogP0.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.21
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;fluoromethane;3-fluoro-1-methylpyrrolidine
CID 177157428
(3S)-3-fluoro-1-methylpyrrolidine;methoxyethane
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(2S,4R)-2-deuterio-4-fluoro-1-methylpyrrolidine
CID 175740234
(3S)-3-fluoro-1-[(1-methylazetidin-3-yl)methyl]pyrrolidine
CID 134177865
4-ethyl-1-methylpiperidine;methoxymethane
CID 90698783
(3R)-1-methyl-3-(methylsulfanyloxymethyl)pyrrolidine
CID 139553524
methanol;3-methoxy-1-methylpyrrolidine
CID 164878451
(3S)-3-fluoro-4-iodo-1-methylpiperidine
CID 167016263
4-fluoro-1-methylpiperidine;4-methylmorpholine
CID 153371912
1-methylpyrrolidin-3-amine;sulfanol
CID 143564913
(3R)-1,3-dimethylpyrrolidine
CID 58412242
ethane;1-methylpiperidin-4-amine
CID 123622295

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1-methylpyrrolidine;methoxymethane?
The IUPAC name of 3-fluoro-1-methylpyrrolidine;methoxymethane (CID 162743316) is 3-fluoro-1-methylpyrrolidine;methoxymethane.
What is the SMILES notation for 3-fluoro-1-methylpyrrolidine;methoxymethane?
The canonical SMILES for 3-fluoro-1-methylpyrrolidine;methoxymethane is CN1CCC(F)C1.COC.
What is the InChIKey of 3-fluoro-1-methylpyrrolidine;methoxymethane?
The InChIKey is IOTWXTPODVCWPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN.C2H6O/c1-7-3-2-5(6)4-7;1-3-2/h5H,2-4H2,1H3;1-2H3.
What are the key properties of 3-fluoro-1-methylpyrrolidine;methoxymethane?
3-fluoro-1-methylpyrrolidine;methoxymethane has a molecular weight of 149.21 g/mol, XLogP of 0.92, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1-methylpyrrolidine;methoxymethane is sourced from PubChem (CID 162743316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).