3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine

C10H15F2N3 — CID 84734904

IUPAC3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine
SMILESFC(F)c1cnn(CC2CCCNC2)c1
InChIInChI=1S/C10H15F2N3/c11-10(12)9-5-14-15(7-9)6-8-2-1-3-13-4-8/h5,7-8,10,13H,1-4,6H2
InChIKeyRQCBYTAORFPZLL-UHFFFAOYSA-N
MW215.25 g/mol
LogP1.82
Rot. Bonds3

About 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine

3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine (PubChem CID 84734904) has the molecular formula C10H15F2N3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine.

Molecular Properties

Compound Name3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine
PubChem CID84734904
Molecular FormulaC10H15F2N3
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine
SMILESFC(F)c1cnn(CC2CCCNC2)c1
InChIInChI=1S/C10H15F2N3/c11-10(12)9-5-14-15(7-9)6-8-2-1-3-13-4-8/h5,7-8,10,13H,1-4,6H2
InChIKeyRQCBYTAORFPZLL-UHFFFAOYSA-N
XLogP1.82
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine?
The IUPAC name of 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine (CID 84734904) is 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine.
What is the SMILES notation for 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine?
The canonical SMILES for 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine is FC(F)c1cnn(CC2CCCNC2)c1.
What is the InChIKey of 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine?
The InChIKey is RQCBYTAORFPZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2N3/c11-10(12)9-5-14-15(7-9)6-8-2-1-3-13-4-8/h5,7-8,10,13H,1-4,6H2.
What are the key properties of 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine?
3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine has a molecular weight of 215.25 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(difluoromethyl)pyrazol-1-yl]methyl]piperidine is sourced from PubChem (CID 84734904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).