4-(difluoromethylidene)piperidine;hydrochloride

C6H10ClF2N — CID 23448141

IUPAC4-(difluoromethylidene)piperidine;hydrochloride
SMILESCl.FC(F)=C1CCNCC1
InChIInChI=1S/C6H9F2N.ClH/c7-6(8)5-1-3-9-4-2-5;/h9H,1-4H2;1H
InChIKeyRGXCXVJYDBNGMU-UHFFFAOYSA-N
MW169.60 g/mol
LogP1.94
Rot. Bonds

About 4-(difluoromethylidene)piperidine;hydrochloride

4-(difluoromethylidene)piperidine;hydrochloride (PubChem CID 23448141) has the molecular formula C6H10ClF2N and a molecular weight of 169.60 g/mol. Its IUPAC name is 4-(difluoromethylidene)piperidine;hydrochloride.

Molecular Properties

Compound Name4-(difluoromethylidene)piperidine;hydrochloride
PubChem CID23448141
Molecular FormulaC6H10ClF2N
Molecular Weight169.60 g/mol
Exact Mass169.05
IUPAC Name4-(difluoromethylidene)piperidine;hydrochloride
SMILESCl.FC(F)=C1CCNCC1
InChIInChI=1S/C6H9F2N.ClH/c7-6(8)5-1-3-9-4-2-5;/h9H,1-4H2;1H
InChIKeyRGXCXVJYDBNGMU-UHFFFAOYSA-N
XLogP1.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.60
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethylidene)piperidine;hydrochloride?
The IUPAC name of 4-(difluoromethylidene)piperidine;hydrochloride (CID 23448141) is 4-(difluoromethylidene)piperidine;hydrochloride.
What is the SMILES notation for 4-(difluoromethylidene)piperidine;hydrochloride?
The canonical SMILES for 4-(difluoromethylidene)piperidine;hydrochloride is Cl.FC(F)=C1CCNCC1.
What is the InChIKey of 4-(difluoromethylidene)piperidine;hydrochloride?
The InChIKey is RGXCXVJYDBNGMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2N.ClH/c7-6(8)5-1-3-9-4-2-5;/h9H,1-4H2;1H.
What are the key properties of 4-(difluoromethylidene)piperidine;hydrochloride?
4-(difluoromethylidene)piperidine;hydrochloride has a molecular weight of 169.60 g/mol, XLogP of 1.94, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethylidene)piperidine;hydrochloride is sourced from PubChem (CID 23448141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).