4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine

C8H16FNO — CID 146652769

IUPAC4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine
SMILESCOCC1(C)CC(F)CN1C
InChIInChI=1S/C8H16FNO/c1-8(6-11-3)4-7(9)5-10(8)2/h7H,4-6H2,1-3H3
InChIKeyOPWAOUUHCRGJCV-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.07
Rot. Bonds2

About 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine

4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine (PubChem CID 146652769) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine.

Molecular Properties

Compound Name4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine
PubChem CID146652769
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine
SMILESCOCC1(C)CC(F)CN1C
InChIInChI=1S/C8H16FNO/c1-8(6-11-3)4-7(9)5-10(8)2/h7H,4-6H2,1-3H3
InChIKeyOPWAOUUHCRGJCV-UHFFFAOYSA-N
XLogP1.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Fluoro-2-(methoxymethyl)-1,4-di(propan-2-yl)pyrrolidine
CID 58778841
(2S,4R)-1-tert-butyl-4-fluoro-2-(methoxymethyl)pyrrolidine
CID 59028649
(2S,4S)-4-fluoro-2-(methoxymethyl)-1-methylpyrrolidine
CID 68087112
2-(Ethoxymethyl)-4-fluoro-1-methylpyrrolidine
CID 76646808
4-Fluoro-2-(methoxymethyl)-1-methylpyrrolidine
CID 76646851
(2S,4R)-1-ethyl-4-fluoro-2-(methoxymethyl)pyrrolidine
CID 89317886
2-(Methoxymethyl)-1-methyl-2-(2,2,2-trifluoroethyl)pyrrolidine
CID 118615691
1-Ethyl-2-(methoxymethyl)-2-(2,2,2-trifluoroethyl)pyrrolidine
CID 118615712
2-(2,2-Difluoropropyl)-2-(methoxymethyl)-1-propan-2-ylpyrrolidine
CID 130399562
2-(Methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine
CID 130399588
[1-(2-Fluoroethyl)-2-methylpyrrolidin-2-yl]methanol
CID 130644994
1-(2-Fluoroethyl)-2-(methoxymethyl)pyrrolidine
CID 131202671

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine?
The IUPAC name of 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine (CID 146652769) is 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine.
What is the SMILES notation for 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine?
The canonical SMILES for 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine is COCC1(C)CC(F)CN1C.
What is the InChIKey of 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine?
The InChIKey is OPWAOUUHCRGJCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-8(6-11-3)4-7(9)5-10(8)2/h7H,4-6H2,1-3H3.
What are the key properties of 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine?
4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine has a molecular weight of 161.22 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(methoxymethyl)-1,2-dimethylpyrrolidine is sourced from PubChem (CID 146652769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).