2,2-difluoro-3-piperidin-1-ylpropanehydrazide

C8H15F2N3O — CID 165462023

IUPAC2,2-difluoro-3-piperidin-1-ylpropanehydrazide
SMILESNNC(=O)C(F)(F)CN1CCCCC1
InChIInChI=1S/C8H15F2N3O/c9-8(10,7(14)12-11)6-13-4-2-1-3-5-13/h1-6,11H2,(H,12,14)
InChIKeyYYTMAYHETCZFAP-UHFFFAOYSA-N
MW207.22 g/mol
LogP0.10
Rot. Bonds3

About 2,2-difluoro-3-piperidin-1-ylpropanehydrazide

2,2-difluoro-3-piperidin-1-ylpropanehydrazide (PubChem CID 165462023) has the molecular formula C8H15F2N3O and a molecular weight of 207.22 g/mol. Its IUPAC name is 2,2-difluoro-3-piperidin-1-ylpropanehydrazide.

Molecular Properties

Compound Name2,2-difluoro-3-piperidin-1-ylpropanehydrazide
PubChem CID165462023
Molecular FormulaC8H15F2N3O
Molecular Weight207.22 g/mol
Exact Mass207.12
IUPAC Name2,2-difluoro-3-piperidin-1-ylpropanehydrazide
SMILESNNC(=O)C(F)(F)CN1CCCCC1
InChIInChI=1S/C8H15F2N3O/c9-8(10,7(14)12-11)6-13-4-2-1-3-5-13/h1-6,11H2,(H,12,14)
InChIKeyYYTMAYHETCZFAP-UHFFFAOYSA-N
XLogP0.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.22
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-3-piperidin-1-ylpropanehydrazide?
The IUPAC name of 2,2-difluoro-3-piperidin-1-ylpropanehydrazide (CID 165462023) is 2,2-difluoro-3-piperidin-1-ylpropanehydrazide.
What is the SMILES notation for 2,2-difluoro-3-piperidin-1-ylpropanehydrazide?
The canonical SMILES for 2,2-difluoro-3-piperidin-1-ylpropanehydrazide is NNC(=O)C(F)(F)CN1CCCCC1.
What is the InChIKey of 2,2-difluoro-3-piperidin-1-ylpropanehydrazide?
The InChIKey is YYTMAYHETCZFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2N3O/c9-8(10,7(14)12-11)6-13-4-2-1-3-5-13/h1-6,11H2,(H,12,14).
What are the key properties of 2,2-difluoro-3-piperidin-1-ylpropanehydrazide?
2,2-difluoro-3-piperidin-1-ylpropanehydrazide has a molecular weight of 207.22 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-3-piperidin-1-ylpropanehydrazide is sourced from PubChem (CID 165462023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).