2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine

C8H16FNO — CID 131219739

IUPAC2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine
SMILESCOCCN1CCCC1CF
InChIInChI=1S/C8H16FNO/c1-11-6-5-10-4-2-3-8(10)7-9/h8H,2-7H2,1H3
InChIKeyYWPFNWCHUMNGET-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.07
Rot. Bonds4

About 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine

2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine (PubChem CID 131219739) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine.

Molecular Properties

Compound Name2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine
PubChem CID131219739
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine
SMILESCOCCN1CCCC1CF
InChIInChI=1S/C8H16FNO/c1-11-6-5-10-4-2-3-8(10)7-9/h8H,2-7H2,1H3
InChIKeyYWPFNWCHUMNGET-UHFFFAOYSA-N
XLogP1.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
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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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine?
The IUPAC name of 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine (CID 131219739) is 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine.
What is the SMILES notation for 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine?
The canonical SMILES for 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine is COCCN1CCCC1CF.
What is the InChIKey of 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine?
The InChIKey is YWPFNWCHUMNGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-11-6-5-10-4-2-3-8(10)7-9/h8H,2-7H2,1H3.
What are the key properties of 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine?
2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine has a molecular weight of 161.22 g/mol, XLogP of 1.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1-(2-methoxyethyl)pyrrolidine is sourced from PubChem (CID 131219739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).