1-(3-fluoroprop-2-enyl)pyrrolidine

C7H12FN — CID 68636999

IUPAC1-(3-fluoroprop-2-enyl)pyrrolidine
SMILESFC=CCN1CCCC1
InChIInChI=1S/C7H12FN/c8-4-3-7-9-5-1-2-6-9/h3-4H,1-2,5-7H2
InChIKeyHJDCKGIDLWWVPJ-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.57
Rot. Bonds2

About 1-(3-fluoroprop-2-enyl)pyrrolidine

1-(3-fluoroprop-2-enyl)pyrrolidine (PubChem CID 68636999) has the molecular formula C7H12FN and a molecular weight of 129.18 g/mol. Its IUPAC name is 1-(3-fluoroprop-2-enyl)pyrrolidine.

Molecular Properties

Compound Name1-(3-fluoroprop-2-enyl)pyrrolidine
PubChem CID68636999
Molecular FormulaC7H12FN
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name1-(3-fluoroprop-2-enyl)pyrrolidine
SMILESFC=CCN1CCCC1
InChIInChI=1S/C7H12FN/c8-4-3-7-9-5-1-2-6-9/h3-4H,1-2,5-7H2
InChIKeyHJDCKGIDLWWVPJ-UHFFFAOYSA-N
XLogP1.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoroprop-2-enyl)pyrrolidine?
The IUPAC name of 1-(3-fluoroprop-2-enyl)pyrrolidine (CID 68636999) is 1-(3-fluoroprop-2-enyl)pyrrolidine.
What is the SMILES notation for 1-(3-fluoroprop-2-enyl)pyrrolidine?
The canonical SMILES for 1-(3-fluoroprop-2-enyl)pyrrolidine is FC=CCN1CCCC1.
What is the InChIKey of 1-(3-fluoroprop-2-enyl)pyrrolidine?
The InChIKey is HJDCKGIDLWWVPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FN/c8-4-3-7-9-5-1-2-6-9/h3-4H,1-2,5-7H2.
What are the key properties of 1-(3-fluoroprop-2-enyl)pyrrolidine?
1-(3-fluoroprop-2-enyl)pyrrolidine has a molecular weight of 129.18 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoroprop-2-enyl)pyrrolidine is sourced from PubChem (CID 68636999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).