2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane

C11H23F2N — CID 170772133

IUPAC2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane
SMILESCC.CC(C)C1CCCC(C(F)F)N1
InChIInChI=1S/C9H17F2N.C2H6/c1-6(2)7-4-3-5-8(12-7)9(10)11;1-2/h6-9,12H,3-5H2,1-2H3;1-2H3
InChIKeyPRWQKGFPIPBVKU-UHFFFAOYSA-N
MW207.31 g/mol
LogP3.44
Rot. Bonds2

About 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane

2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane (PubChem CID 170772133) has the molecular formula C11H23F2N and a molecular weight of 207.31 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane.

Molecular Properties

Compound Name2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane
PubChem CID170772133
Molecular FormulaC11H23F2N
Molecular Weight207.31 g/mol
Exact Mass207.18
IUPAC Name2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane
SMILESCC.CC(C)C1CCCC(C(F)F)N1
InChIInChI=1S/C9H17F2N.C2H6/c1-6(2)7-4-3-5-8(12-7)9(10)11;1-2/h6-9,12H,3-5H2,1-2H3;1-2H3
InChIKeyPRWQKGFPIPBVKU-UHFFFAOYSA-N
XLogP3.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.31
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane?
The IUPAC name of 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane (CID 170772133) is 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane.
What is the SMILES notation for 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane?
The canonical SMILES for 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane is CC.CC(C)C1CCCC(C(F)F)N1.
What is the InChIKey of 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane?
The InChIKey is PRWQKGFPIPBVKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F2N.C2H6/c1-6(2)7-4-3-5-8(12-7)9(10)11;1-2/h6-9,12H,3-5H2,1-2H3;1-2H3.
What are the key properties of 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane?
2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane has a molecular weight of 207.31 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-propan-2-ylpiperidine;ethane is sourced from PubChem (CID 170772133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).