1-(1,2-difluoroprop-2-enyl)pyrrolidine

C7H11F2N — CID 129207790

IUPAC1-(1,2-difluoroprop-2-enyl)pyrrolidine
SMILESC=C(F)C(F)N1CCCC1
InChIInChI=1S/C7H11F2N/c1-6(8)7(9)10-4-2-3-5-10/h7H,1-5H2
InChIKeyVEUCIRKFAXEJCA-UHFFFAOYSA-N
MW147.17 g/mol
LogP1.86
Rot. Bonds2

About 1-(1,2-difluoroprop-2-enyl)pyrrolidine

1-(1,2-difluoroprop-2-enyl)pyrrolidine (PubChem CID 129207790) has the molecular formula C7H11F2N and a molecular weight of 147.17 g/mol. Its IUPAC name is 1-(1,2-difluoroprop-2-enyl)pyrrolidine.

Molecular Properties

Compound Name1-(1,2-difluoroprop-2-enyl)pyrrolidine
PubChem CID129207790
Molecular FormulaC7H11F2N
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name1-(1,2-difluoroprop-2-enyl)pyrrolidine
SMILESC=C(F)C(F)N1CCCC1
InChIInChI=1S/C7H11F2N/c1-6(8)7(9)10-4-2-3-5-10/h7H,1-5H2
InChIKeyVEUCIRKFAXEJCA-UHFFFAOYSA-N
XLogP1.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2-difluoroprop-2-enyl)pyrrolidine?
The IUPAC name of 1-(1,2-difluoroprop-2-enyl)pyrrolidine (CID 129207790) is 1-(1,2-difluoroprop-2-enyl)pyrrolidine.
What is the SMILES notation for 1-(1,2-difluoroprop-2-enyl)pyrrolidine?
The canonical SMILES for 1-(1,2-difluoroprop-2-enyl)pyrrolidine is C=C(F)C(F)N1CCCC1.
What is the InChIKey of 1-(1,2-difluoroprop-2-enyl)pyrrolidine?
The InChIKey is VEUCIRKFAXEJCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2N/c1-6(8)7(9)10-4-2-3-5-10/h7H,1-5H2.
What are the key properties of 1-(1,2-difluoroprop-2-enyl)pyrrolidine?
1-(1,2-difluoroprop-2-enyl)pyrrolidine has a molecular weight of 147.17 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-difluoroprop-2-enyl)pyrrolidine is sourced from PubChem (CID 129207790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).