(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine

C8H14FN — CID 166928477

IUPAC(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine
SMILESC=C(C)[C@H]1C[C@H](F)CN1C
InChIInChI=1S/C8H14FN/c1-6(2)8-4-7(9)5-10(8)3/h7-8H,1,4-5H2,2-3H3/t7-,8+/m0/s1
InChIKeyZRYKOZOJVURJRB-JGVFFNPUSA-N
MW143.20 g/mol
LogP1.60
Rot. Bonds1

About (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine

(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine (PubChem CID 166928477) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine.

Molecular Properties

Compound Name(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine
PubChem CID166928477
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine
SMILESC=C(C)[C@H]1C[C@H](F)CN1C
InChIInChI=1S/C8H14FN/c1-6(2)8-4-7(9)5-10(8)3/h7-8H,1,4-5H2,2-3H3/t7-,8+/m0/s1
InChIKeyZRYKOZOJVURJRB-JGVFFNPUSA-N
XLogP1.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine?
The IUPAC name of (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine (CID 166928477) is (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine.
What is the SMILES notation for (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine?
The canonical SMILES for (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine is C=C(C)[C@H]1C[C@H](F)CN1C.
What is the InChIKey of (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine?
The InChIKey is ZRYKOZOJVURJRB-JGVFFNPUSA-N. The full InChI is InChI=1S/C8H14FN/c1-6(2)8-4-7(9)5-10(8)3/h7-8H,1,4-5H2,2-3H3/t7-,8+/m0/s1.
What are the key properties of (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine?
(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine has a molecular weight of 143.20 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine is sourced from PubChem (CID 166928477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).