2-(1-fluoroprop-2-enyl)pyrrolidine

C7H12FN — CID 106640300

IUPAC2-(1-fluoroprop-2-enyl)pyrrolidine
SMILESC=CC(F)C1CCCN1
InChIInChI=1S/C7H12FN/c1-2-6(8)7-4-3-5-9-7/h2,6-7,9H,1,3-5H2
InChIKeyFANYMQCZYMLMBK-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.26
Rot. Bonds2

About 2-(1-fluoroprop-2-enyl)pyrrolidine

2-(1-fluoroprop-2-enyl)pyrrolidine (PubChem CID 106640300) has the molecular formula C7H12FN and a molecular weight of 129.18 g/mol. Its IUPAC name is 2-(1-fluoroprop-2-enyl)pyrrolidine.

Molecular Properties

Compound Name2-(1-fluoroprop-2-enyl)pyrrolidine
PubChem CID106640300
Molecular FormulaC7H12FN
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name2-(1-fluoroprop-2-enyl)pyrrolidine
SMILESC=CC(F)C1CCCN1
InChIInChI=1S/C7H12FN/c1-2-6(8)7-4-3-5-9-7/h2,6-7,9H,1,3-5H2
InChIKeyFANYMQCZYMLMBK-UHFFFAOYSA-N
XLogP1.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.26
H-Bond Donors ≤ 51
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 2-(1-fluoroprop-2-enyl)pyrrolidine?
The IUPAC name of 2-(1-fluoroprop-2-enyl)pyrrolidine (CID 106640300) is 2-(1-fluoroprop-2-enyl)pyrrolidine.
What is the SMILES notation for 2-(1-fluoroprop-2-enyl)pyrrolidine?
The canonical SMILES for 2-(1-fluoroprop-2-enyl)pyrrolidine is C=CC(F)C1CCCN1.
What is the InChIKey of 2-(1-fluoroprop-2-enyl)pyrrolidine?
The InChIKey is FANYMQCZYMLMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FN/c1-2-6(8)7-4-3-5-9-7/h2,6-7,9H,1,3-5H2.
What are the key properties of 2-(1-fluoroprop-2-enyl)pyrrolidine?
2-(1-fluoroprop-2-enyl)pyrrolidine has a molecular weight of 129.18 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoroprop-2-enyl)pyrrolidine is sourced from PubChem (CID 106640300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).