1-(2,2-difluoroethyl)pyrrolidine

C6H11F2N — CID 87193198

IUPAC1-(2,2-difluoroethyl)pyrrolidine
SMILESFC(F)CN1CCCC1
InChIInChI=1S/C6H11F2N/c7-6(8)5-9-3-1-2-4-9/h6H,1-5H2
InChIKeyFWEFCNZXIPQRNI-UHFFFAOYSA-N
MW135.16 g/mol
LogP1.35
Rot. Bonds2

About 1-(2,2-difluoroethyl)pyrrolidine

1-(2,2-difluoroethyl)pyrrolidine (PubChem CID 87193198) has the molecular formula C6H11F2N and a molecular weight of 135.16 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)pyrrolidine.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)pyrrolidine
PubChem CID87193198
Molecular FormulaC6H11F2N
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC Name1-(2,2-difluoroethyl)pyrrolidine
SMILESFC(F)CN1CCCC1
InChIInChI=1S/C6H11F2N/c7-6(8)5-9-3-1-2-4-9/h6H,1-5H2
InChIKeyFWEFCNZXIPQRNI-UHFFFAOYSA-N
XLogP1.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.16
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2,2-Trifluoroethyl)pyrrolidine
CID 21810045
Difluoropyrrolidine
CID 17885416
1-(Fluoromethyl)pyrrolidine
CID 18762940
Trifluoromethylpyrrolidine
CID 22011299
Tetrafluoropyrrolidine
CID 22011300
1-(2-Fluoroethyl)pyrrolidine
CID 54216065
3-Fluoro-1-methylpyrrolidine
CID 57749492
fluoro-N-methylpyrrolidine
CID 89989596
Fluoropropyl-pyrrolidine
CID 130163099
2,2,3,4,5,5-Hexafluoro-1-methylpyrrolidine
CID 12847250
3,3,4,4-Tetrafluoro-1-methylpyrrolidine
CID 13028735
1-[(E)-1,2,3,3,3-pentafluoroprop-1-enyl]pyrrolidine
CID 13864934

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)pyrrolidine?
The IUPAC name of 1-(2,2-difluoroethyl)pyrrolidine (CID 87193198) is 1-(2,2-difluoroethyl)pyrrolidine.
What is the SMILES notation for 1-(2,2-difluoroethyl)pyrrolidine?
The canonical SMILES for 1-(2,2-difluoroethyl)pyrrolidine is FC(F)CN1CCCC1.
What is the InChIKey of 1-(2,2-difluoroethyl)pyrrolidine?
The InChIKey is FWEFCNZXIPQRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N/c7-6(8)5-9-3-1-2-4-9/h6H,1-5H2.
What are the key properties of 1-(2,2-difluoroethyl)pyrrolidine?
1-(2,2-difluoroethyl)pyrrolidine has a molecular weight of 135.16 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)pyrrolidine is sourced from PubChem (CID 87193198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).