(4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine

C8H16FN — CID 167468661

IUPAC(4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine
SMILESCCC1(C)C[C@@H](F)CN1C
InChIInChI=1S/C8H16FN/c1-4-8(2)5-7(9)6-10(8)3/h7H,4-6H2,1-3H3/t7-,8?/m1/s1
InChIKeyDKTQGEJBZGLZOI-GVHYBUMESA-N
MW145.22 g/mol
LogP1.83
Rot. Bonds1

About (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine

(4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine (PubChem CID 167468661) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine.

Molecular Properties

Compound Name(4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine
PubChem CID167468661
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name(4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine
SMILESCCC1(C)C[C@@H](F)CN1C
InChIInChI=1S/C8H16FN/c1-4-8(2)5-7(9)6-10(8)3/h7H,4-6H2,1-3H3/t7-,8?/m1/s1
InChIKeyDKTQGEJBZGLZOI-GVHYBUMESA-N
XLogP1.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine?
The IUPAC name of (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine (CID 167468661) is (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine.
What is the SMILES notation for (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine?
The canonical SMILES for (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine is CCC1(C)C[C@@H](F)CN1C.
What is the InChIKey of (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine?
The InChIKey is DKTQGEJBZGLZOI-GVHYBUMESA-N. The full InChI is InChI=1S/C8H16FN/c1-4-8(2)5-7(9)6-10(8)3/h7H,4-6H2,1-3H3/t7-,8?/m1/s1.
What are the key properties of (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine?
(4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine has a molecular weight of 145.22 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-ethyl-4-fluoro-1,2-dimethylpyrrolidine is sourced from PubChem (CID 167468661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).