2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide

C8H13F4NO2 — CID 103528341

IUPAC2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
SMILESCC(C)OCC(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H13F4NO2/c1-5(2)15-3-6(14)13-4-8(11,12)7(9)10/h5,7H,3-4H2,1-2H3,(H,13,14)
InChIKeyDANPIWLWXPILAC-UHFFFAOYSA-N
MW231.19 g/mol
LogP1.43
Rot. Bonds6

About 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide

2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide (PubChem CID 103528341) has the molecular formula C8H13F4NO2 and a molecular weight of 231.19 g/mol. Its IUPAC name is 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide.

Molecular Properties

Compound Name2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
PubChem CID103528341
Molecular FormulaC8H13F4NO2
Molecular Weight231.19 g/mol
Exact Mass231.09
IUPAC Name2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
SMILESCC(C)OCC(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H13F4NO2/c1-5(2)15-3-6(14)13-4-8(11,12)7(9)10/h5,7H,3-4H2,1-2H3,(H,13,14)
InChIKeyDANPIWLWXPILAC-UHFFFAOYSA-N
XLogP1.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.19
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 103528809
4-hydroxy-N-(2,2,3,3-tetrafluoropropyl)pentanamide
CID 106295708
methyl N-(2,2,3,3-tetrafluoropropyl)carbamate
CID 103528765
2-sulfanyl-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 106295758
N-(4-methoxy-2,2-dimethylbutyl)-2-propan-2-yloxyacetamide
CID 104625347
2-ethyl-2-[[(2-propan-2-yloxyacetyl)amino]methyl]butanoic acid
CID 112555185
methyl 2-[(2-propan-2-yloxyacetyl)amino]acetate
CID 112686620
1-propan-2-yloxy-3-(2,2,3,3-tetrafluoropropoxy)propan-2-one
CID 103473882
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-propan-2-yloxyacetamide
CID 103840231
2-methyl-3-oxo-3-(2,2,3,3-tetrafluoropropylamino)propanoic acid
CID 106295621
3-(ethylamino)-N-(2,2,3,3-tetrafluoropropyl)propanamide
CID 106291636
2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 106291856

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide?
The IUPAC name of 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide (CID 103528341) is 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide.
What is the SMILES notation for 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide?
The canonical SMILES for 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide is CC(C)OCC(=O)NCC(F)(F)C(F)F.
What is the InChIKey of 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide?
The InChIKey is DANPIWLWXPILAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F4NO2/c1-5(2)15-3-6(14)13-4-8(11,12)7(9)10/h5,7H,3-4H2,1-2H3,(H,13,14).
What are the key properties of 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide?
2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide has a molecular weight of 231.19 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide is sourced from PubChem (CID 103528341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).