4,4-difluoro-2-methylidenepyrrolidine

C5H7F2N — CID 155057074

IUPAC4,4-difluoro-2-methylidenepyrrolidine
SMILESC=C1CC(F)(F)CN1
InChIInChI=1S/C5H7F2N/c1-4-2-5(6,7)3-8-4/h8H,1-3H2
InChIKeyLHZWBRHFSCUPPD-UHFFFAOYSA-N
MW119.11 g/mol
LogP1.13
Rot. Bonds

About 4,4-difluoro-2-methylidenepyrrolidine

4,4-difluoro-2-methylidenepyrrolidine (PubChem CID 155057074) has the molecular formula C5H7F2N and a molecular weight of 119.11 g/mol. Its IUPAC name is 4,4-difluoro-2-methylidenepyrrolidine.

Molecular Properties

Compound Name4,4-difluoro-2-methylidenepyrrolidine
PubChem CID155057074
Molecular FormulaC5H7F2N
Molecular Weight119.11 g/mol
Exact Mass119.05
IUPAC Name4,4-difluoro-2-methylidenepyrrolidine
SMILESC=C1CC(F)(F)CN1
InChIInChI=1S/C5H7F2N/c1-4-2-5(6,7)3-8-4/h8H,1-3H2
InChIKeyLHZWBRHFSCUPPD-UHFFFAOYSA-N
XLogP1.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.11
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-2-methylidenepyrrolidine?
The IUPAC name of 4,4-difluoro-2-methylidenepyrrolidine (CID 155057074) is 4,4-difluoro-2-methylidenepyrrolidine.
What is the SMILES notation for 4,4-difluoro-2-methylidenepyrrolidine?
The canonical SMILES for 4,4-difluoro-2-methylidenepyrrolidine is C=C1CC(F)(F)CN1.
What is the InChIKey of 4,4-difluoro-2-methylidenepyrrolidine?
The InChIKey is LHZWBRHFSCUPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F2N/c1-4-2-5(6,7)3-8-4/h8H,1-3H2.
What are the key properties of 4,4-difluoro-2-methylidenepyrrolidine?
4,4-difluoro-2-methylidenepyrrolidine has a molecular weight of 119.11 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-2-methylidenepyrrolidine is sourced from PubChem (CID 155057074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).