1-ethenyl-3,3-difluoropiperidine

C7H11F2N — CID 145468348

IUPAC1-ethenyl-3,3-difluoropiperidine
SMILESC=CN1CCCC(F)(F)C1
InChIInChI=1S/C7H11F2N/c1-2-10-5-3-4-7(8,9)6-10/h2H,1,3-6H2
InChIKeyLFEZZENCUAHOLD-UHFFFAOYSA-N
MW147.17 g/mol
LogP1.86
Rot. Bonds1

About 1-ethenyl-3,3-difluoropiperidine

1-ethenyl-3,3-difluoropiperidine (PubChem CID 145468348) has the molecular formula C7H11F2N and a molecular weight of 147.17 g/mol. Its IUPAC name is 1-ethenyl-3,3-difluoropiperidine.

Molecular Properties

Compound Name1-ethenyl-3,3-difluoropiperidine
PubChem CID145468348
Molecular FormulaC7H11F2N
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name1-ethenyl-3,3-difluoropiperidine
SMILESC=CN1CCCC(F)(F)C1
InChIInChI=1S/C7H11F2N/c1-2-10-5-3-4-7(8,9)6-10/h2H,1,3-6H2
InChIKeyLFEZZENCUAHOLD-UHFFFAOYSA-N
XLogP1.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
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

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3,3-difluoropiperidine?
The IUPAC name of 1-ethenyl-3,3-difluoropiperidine (CID 145468348) is 1-ethenyl-3,3-difluoropiperidine.
What is the SMILES notation for 1-ethenyl-3,3-difluoropiperidine?
The canonical SMILES for 1-ethenyl-3,3-difluoropiperidine is C=CN1CCCC(F)(F)C1.
What is the InChIKey of 1-ethenyl-3,3-difluoropiperidine?
The InChIKey is LFEZZENCUAHOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2N/c1-2-10-5-3-4-7(8,9)6-10/h2H,1,3-6H2.
What are the key properties of 1-ethenyl-3,3-difluoropiperidine?
1-ethenyl-3,3-difluoropiperidine has a molecular weight of 147.17 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3,3-difluoropiperidine is sourced from PubChem (CID 145468348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).