2-(difluoromethyl)-2-methylpiperidine

C7H13F2N — CID 84763126

IUPAC2-(difluoromethyl)-2-methylpiperidine
SMILESCC1(C(F)F)CCCCN1
InChIInChI=1S/C7H13F2N/c1-7(6(8)9)4-2-3-5-10-7/h6,10H,2-5H2,1H3
InChIKeyAVGVUFBDWOOEHR-UHFFFAOYSA-N
MW149.18 g/mol
LogP1.78
Rot. Bonds1

About 2-(difluoromethyl)-2-methylpiperidine

2-(difluoromethyl)-2-methylpiperidine (PubChem CID 84763126) has the molecular formula C7H13F2N and a molecular weight of 149.18 g/mol. Its IUPAC name is 2-(difluoromethyl)-2-methylpiperidine.

Molecular Properties

Compound Name2-(difluoromethyl)-2-methylpiperidine
PubChem CID84763126
Molecular FormulaC7H13F2N
Molecular Weight149.18 g/mol
Exact Mass149.10
IUPAC Name2-(difluoromethyl)-2-methylpiperidine
SMILESCC1(C(F)F)CCCCN1
InChIInChI=1S/C7H13F2N/c1-7(6(8)9)4-2-3-5-10-7/h6,10H,2-5H2,1H3
InChIKeyAVGVUFBDWOOEHR-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.18
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-2-methylpiperidine?
The IUPAC name of 2-(difluoromethyl)-2-methylpiperidine (CID 84763126) is 2-(difluoromethyl)-2-methylpiperidine.
What is the SMILES notation for 2-(difluoromethyl)-2-methylpiperidine?
The canonical SMILES for 2-(difluoromethyl)-2-methylpiperidine is CC1(C(F)F)CCCCN1.
What is the InChIKey of 2-(difluoromethyl)-2-methylpiperidine?
The InChIKey is AVGVUFBDWOOEHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2N/c1-7(6(8)9)4-2-3-5-10-7/h6,10H,2-5H2,1H3.
What are the key properties of 2-(difluoromethyl)-2-methylpiperidine?
2-(difluoromethyl)-2-methylpiperidine has a molecular weight of 149.18 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-2-methylpiperidine is sourced from PubChem (CID 84763126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).