2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine

C7H13F4NO — CID 62355623

IUPAC2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine
SMILESCC(C)(CN)OCC(F)(F)C(F)F
InChIInChI=1S/C7H13F4NO/c1-6(2,3-12)13-4-7(10,11)5(8)9/h5H,3-4,12H2,1-2H3
InChIKeyNPVJMZAWOZPQDE-UHFFFAOYSA-N
MW203.18 g/mol
LogP1.64
Rot. Bonds5

About 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine

2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine (PubChem CID 62355623) has the molecular formula C7H13F4NO and a molecular weight of 203.18 g/mol. Its IUPAC name is 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine
PubChem CID62355623
Molecular FormulaC7H13F4NO
Molecular Weight203.18 g/mol
Exact Mass203.09
IUPAC Name2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine
SMILESCC(C)(CN)OCC(F)(F)C(F)F
InChIInChI=1S/C7H13F4NO/c1-6(2,3-12)13-4-7(10,11)5(8)9/h5H,3-4,12H2,1-2H3
InChIKeyNPVJMZAWOZPQDE-UHFFFAOYSA-N
XLogP1.64
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.18
LogP ≤ 51.64
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-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
The IUPAC name of 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine (CID 62355623) is 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine.
What is the SMILES notation for 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
The canonical SMILES for 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine is CC(C)(CN)OCC(F)(F)C(F)F.
What is the InChIKey of 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
The InChIKey is NPVJMZAWOZPQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F4NO/c1-6(2,3-12)13-4-7(10,11)5(8)9/h5H,3-4,12H2,1-2H3.
What are the key properties of 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine has a molecular weight of 203.18 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine is sourced from PubChem (CID 62355623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).