2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine

C10H18FNO — CID 130949171

IUPAC2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine
SMILESCC1(CN2CCCC2CF)COC1
InChIInChI=1S/C10H18FNO/c1-10(7-13-8-10)6-12-4-2-3-9(12)5-11/h9H,2-8H2,1H3
InChIKeyLNGHBOIZTFJVRX-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.46
Rot. Bonds3

About 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine

2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine (PubChem CID 130949171) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine.

Molecular Properties

Compound Name2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine
PubChem CID130949171
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine
SMILESCC1(CN2CCCC2CF)COC1
InChIInChI=1S/C10H18FNO/c1-10(7-13-8-10)6-12-4-2-3-9(12)5-11/h9H,2-8H2,1H3
InChIKeyLNGHBOIZTFJVRX-UHFFFAOYSA-N
XLogP1.46
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-fluoro-1-(3-methoxy-2,2-dimethylpropyl)pyrrolidine
CID 169901490
3-Fluoro-1-(3-methoxy-2,2-dimethylpropyl)pyrrolidine
CID 169903255
3-Ethyl-3-fluoro-1-(oxetan-3-yl)pyrrolidine
CID 177156859
(2S)-1-(3-methoxypropyl)-2-methylpyrrolidine
CID 67965890
(2R)-1-(3-methoxypropyl)-2-methylpyrrolidine
CID 67965896
1-[(3-Methyloxetan-3-yl)methyl]pyrrolidine
CID 130161357
7-Hexan-2-yl-2-oxa-7-azaspiro[3.4]octane
CID 138625328
(2R)-3-fluoro-1,2-dimethylpyrrolidine;methoxyethane
CID 168996092
Ethane;1-(3-methoxypropyl)-2-methylpyrrolidine
CID 176992171
Ethane;3-ethyl-3-fluoro-1-(oxetan-3-yl)pyrrolidine
CID 177156858
1-(3-Methoxypropyl)-2-methylpyrrolidine
CID 77440069

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
The IUPAC name of 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine (CID 130949171) is 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine.
What is the SMILES notation for 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
The canonical SMILES for 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine is CC1(CN2CCCC2CF)COC1.
What is the InChIKey of 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
The InChIKey is LNGHBOIZTFJVRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-10(7-13-8-10)6-12-4-2-3-9(12)5-11/h9H,2-8H2,1H3.
What are the key properties of 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine?
2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine has a molecular weight of 187.26 g/mol, XLogP of 1.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1-[(3-methyloxetan-3-yl)methyl]pyrrolidine is sourced from PubChem (CID 130949171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).