(2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine

C7H13F2NO — CID 129495521

IUPAC(2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine
SMILESCCOC[C@H]1CC(F)(F)CN1
InChIInChI=1S/C7H13F2NO/c1-2-11-4-6-3-7(8,9)5-10-6/h6,10H,2-5H2,1H3/t6-/m1/s1
InChIKeyBMGJRXDQOCIKLV-ZCFIWIBFSA-N
MW165.18 g/mol
LogP1.02
Rot. Bonds3

About (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine

(2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine (PubChem CID 129495521) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine.

Molecular Properties

Compound Name(2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine
PubChem CID129495521
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name(2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine
SMILESCCOC[C@H]1CC(F)(F)CN1
InChIInChI=1S/C7H13F2NO/c1-2-11-4-6-3-7(8,9)5-10-6/h6,10H,2-5H2,1H3/t6-/m1/s1
InChIKeyBMGJRXDQOCIKLV-ZCFIWIBFSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine?
The IUPAC name of (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine (CID 129495521) is (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine.
What is the SMILES notation for (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine?
The canonical SMILES for (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine is CCOC[C@H]1CC(F)(F)CN1.
What is the InChIKey of (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine?
The InChIKey is BMGJRXDQOCIKLV-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H13F2NO/c1-2-11-4-6-3-7(8,9)5-10-6/h6,10H,2-5H2,1H3/t6-/m1/s1.
What are the key properties of (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine?
(2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine has a molecular weight of 165.18 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(ethoxymethyl)-4,4-difluoropyrrolidine is sourced from PubChem (CID 129495521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).