1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine

C8H10F5N — CID 67894316

IUPAC1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine
SMILESFC(F)=C(F)C(F)(F)N1CCCCC1
InChIInChI=1S/C8H10F5N/c9-6(7(10)11)8(12,13)14-4-2-1-3-5-14/h1-5H2
InChIKeyJEPHANQETHXCNU-UHFFFAOYSA-N
MW215.16 g/mol
LogP3.14
Rot. Bonds2

About 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine

1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine (PubChem CID 67894316) has the molecular formula C8H10F5N and a molecular weight of 215.16 g/mol. Its IUPAC name is 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine.

Molecular Properties

Compound Name1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine
PubChem CID67894316
Molecular FormulaC8H10F5N
Molecular Weight215.16 g/mol
Exact Mass215.07
IUPAC Name1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine
SMILESFC(F)=C(F)C(F)(F)N1CCCCC1
InChIInChI=1S/C8H10F5N/c9-6(7(10)11)8(12,13)14-4-2-1-3-5-14/h1-5H2
InChIKeyJEPHANQETHXCNU-UHFFFAOYSA-N
XLogP3.14
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.16
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 10976891
CID 10976891
CID 45790542
CID 45790542
CID 51357996
CID 51357996
CID 177852845
CID 177852845
CID 12554035
CID 12554035
CID 12243783
CID 12243783
CID 162399995
CID 162399995
CID 145231112
CID 145231112
CID 11964063
CID 11964063
CID 13864933
CID 13864933
CID 17997710
CID 17997710
CID 19783528
CID 19783528

Frequently Asked Questions

What is the IUPAC name of 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine?
The IUPAC name of 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine (CID 67894316) is 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine.
What is the SMILES notation for 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine?
The canonical SMILES for 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine is FC(F)=C(F)C(F)(F)N1CCCCC1.
What is the InChIKey of 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine?
The InChIKey is JEPHANQETHXCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F5N/c9-6(7(10)11)8(12,13)14-4-2-1-3-5-14/h1-5H2.
What are the key properties of 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine?
1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine has a molecular weight of 215.16 g/mol, XLogP of 3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1,2,3,3-pentafluoroprop-2-enyl)piperidine is sourced from PubChem (CID 67894316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).