N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine

C11H17F6NO — CID 162536215

IUPACN,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine
SMILESCCN(CC)C1CCC(C(F)(F)C(F)C(F)(F)F)O1
InChIInChI=1S/C11H17F6NO/c1-3-18(4-2)8-6-5-7(19-8)10(13,14)9(12)11(15,16)17/h7-9H,3-6H2,1-2H3
InChIKeyOMJQTHCNJDIPQC-UHFFFAOYSA-N
MW293.25 g/mol
LogP3.37
Rot. Bonds5

About N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine

N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine (PubChem CID 162536215) has the molecular formula C11H17F6NO and a molecular weight of 293.25 g/mol. Its IUPAC name is N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine.

Molecular Properties

Compound NameN,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine
PubChem CID162536215
Molecular FormulaC11H17F6NO
Molecular Weight293.25 g/mol
Exact Mass293.12
IUPAC NameN,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine
SMILESCCN(CC)C1CCC(C(F)(F)C(F)C(F)(F)F)O1
InChIInChI=1S/C11H17F6NO/c1-3-18(4-2)8-6-5-7(19-8)10(13,14)9(12)11(15,16)17/h7-9H,3-6H2,1-2H3
InChIKeyOMJQTHCNJDIPQC-UHFFFAOYSA-N
XLogP3.37
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.25
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine?
The IUPAC name of N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine (CID 162536215) is N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine.
What is the SMILES notation for N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine?
The canonical SMILES for N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine is CCN(CC)C1CCC(C(F)(F)C(F)C(F)(F)F)O1.
What is the InChIKey of N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine?
The InChIKey is OMJQTHCNJDIPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F6NO/c1-3-18(4-2)8-6-5-7(19-8)10(13,14)9(12)11(15,16)17/h7-9H,3-6H2,1-2H3.
What are the key properties of N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine?
N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine has a molecular weight of 293.25 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-(1,1,2,3,3,3-hexafluoropropyl)oxolan-2-amine is sourced from PubChem (CID 162536215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).