2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine

C8H14F5NO — CID 83044935

IUPAC2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine
SMILESCCCC(CN)OCC(F)(F)C(F)(F)F
InChIInChI=1S/C8H14F5NO/c1-2-3-6(4-14)15-5-7(9,10)8(11,12)13/h6H,2-5,14H2,1H3
InChIKeyHHWIFVRJTCHZCM-UHFFFAOYSA-N
MW235.20 g/mol
LogP2.33
Rot. Bonds6

About 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine

2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine (PubChem CID 83044935) has the molecular formula C8H14F5NO and a molecular weight of 235.20 g/mol. Its IUPAC name is 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine.

Molecular Properties

Compound Name2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine
PubChem CID83044935
Molecular FormulaC8H14F5NO
Molecular Weight235.20 g/mol
Exact Mass235.10
IUPAC Name2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine
SMILESCCCC(CN)OCC(F)(F)C(F)(F)F
InChIInChI=1S/C8H14F5NO/c1-2-3-6(4-14)15-5-7(9,10)8(11,12)13/h6H,2-5,14H2,1H3
InChIKeyHHWIFVRJTCHZCM-UHFFFAOYSA-N
XLogP2.33
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.20
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine?
The IUPAC name of 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine (CID 83044935) is 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine.
What is the SMILES notation for 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine?
The canonical SMILES for 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine is CCCC(CN)OCC(F)(F)C(F)(F)F.
What is the InChIKey of 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine?
The InChIKey is HHWIFVRJTCHZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F5NO/c1-2-3-6(4-14)15-5-7(9,10)8(11,12)13/h6H,2-5,14H2,1H3.
What are the key properties of 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine?
2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine has a molecular weight of 235.20 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,3,3,3-pentafluoropropoxy)pentan-1-amine is sourced from PubChem (CID 83044935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).