3,3-difluoro-1-methylpyrrolidine;methoxymethane

C7H15F2NO — CID 162743310

IUPAC3,3-difluoro-1-methylpyrrolidine;methoxymethane
SMILESCN1CCC(F)(F)C1.COC
InChIInChI=1S/C5H9F2N.C2H6O/c1-8-3-2-5(6,7)4-8;1-3-2/h2-4H2,1H3;1-2H3
InChIKeyAYJFCQGDRSCXFE-UHFFFAOYSA-N
MW167.20 g/mol
LogP1.22
Rot. Bonds

About 3,3-difluoro-1-methylpyrrolidine;methoxymethane

3,3-difluoro-1-methylpyrrolidine;methoxymethane (PubChem CID 162743310) has the molecular formula C7H15F2NO and a molecular weight of 167.20 g/mol. Its IUPAC name is 3,3-difluoro-1-methylpyrrolidine;methoxymethane.

Molecular Properties

Compound Name3,3-difluoro-1-methylpyrrolidine;methoxymethane
PubChem CID162743310
Molecular FormulaC7H15F2NO
Molecular Weight167.20 g/mol
Exact Mass167.11
IUPAC Name3,3-difluoro-1-methylpyrrolidine;methoxymethane
SMILESCN1CCC(F)(F)C1.COC
InChIInChI=1S/C5H9F2N.C2H6O/c1-8-3-2-5(6,7)4-8;1-3-2/h2-4H2,1H3;1-2H3
InChIKeyAYJFCQGDRSCXFE-UHFFFAOYSA-N
XLogP1.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.20
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,3-difluoro-1-methylpyrrolidine;methoxymethane 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

Methoxymethylpyrrolidine
CID 11412363
1-[Difluoro(methoxy)methyl]pyrrolidine
CID 18721518
1-[Ethoxy(difluoro)methyl]pyrrolidine
CID 18721520
3,3-Difluoro-1-methylpyrrolidine
CID 20775182
3,3-Difluoro-1-(3-methoxypropyl)pyrrolidine
CID 21035011
1-(1,1,2,2,3,3-Hexafluoro-3-methoxypropyl)pyrrolidine
CID 57884774
3,3-Difluoro-1-(2-methoxyethyl)pyrrolidine
CID 58222106
2,2-Difluoro-1-methylpyrrolidine
CID 59189583
3,3-Difluoro-1-propylpyrrolidine
CID 59295114
1-Methyl-1-(1,1,2-trifluoroethyl)pyrrolidin-1-ium
CID 67090553
1-Methyl-1-(2,2,2-trifluoroethyl)pyrrolidin-1-ium
CID 67090554
1-Methyl-1-(1,2,2-trifluoroethyl)pyrrolidin-1-ium
CID 67090555

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-methylpyrrolidine;methoxymethane?
The IUPAC name of 3,3-difluoro-1-methylpyrrolidine;methoxymethane (CID 162743310) is 3,3-difluoro-1-methylpyrrolidine;methoxymethane.
What is the SMILES notation for 3,3-difluoro-1-methylpyrrolidine;methoxymethane?
The canonical SMILES for 3,3-difluoro-1-methylpyrrolidine;methoxymethane is CN1CCC(F)(F)C1.COC.
What is the InChIKey of 3,3-difluoro-1-methylpyrrolidine;methoxymethane?
The InChIKey is AYJFCQGDRSCXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2N.C2H6O/c1-8-3-2-5(6,7)4-8;1-3-2/h2-4H2,1H3;1-2H3.
What are the key properties of 3,3-difluoro-1-methylpyrrolidine;methoxymethane?
3,3-difluoro-1-methylpyrrolidine;methoxymethane has a molecular weight of 167.20 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-methylpyrrolidine;methoxymethane is sourced from PubChem (CID 162743310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).