2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide

C8H14F4N2O — CID 106291936

IUPAC2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide
SMILESCCC(C)(N)C(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H14F4N2O/c1-3-7(2,13)6(15)14-4-8(11,12)5(9)10/h5H,3-4,13H2,1-2H3,(H,14,15)
InChIKeyWCHXDEHZIIOTCR-UHFFFAOYSA-N
MW230.20 g/mol
LogP1.13
Rot. Bonds5

About 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide

2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide (PubChem CID 106291936) has the molecular formula C8H14F4N2O and a molecular weight of 230.20 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide
PubChem CID106291936
Molecular FormulaC8H14F4N2O
Molecular Weight230.20 g/mol
Exact Mass230.10
IUPAC Name2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide
SMILESCCC(C)(N)C(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H14F4N2O/c1-3-7(2,13)6(15)14-4-8(11,12)5(9)10/h5H,3-4,13H2,1-2H3,(H,14,15)
InChIKeyWCHXDEHZIIOTCR-UHFFFAOYSA-N
XLogP1.13
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.20
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2,2-dimethylpropyl)-2-methylbutanamide
CID 79805965
2-amino-N-(2-hydroxy-2-methylbutyl)-2-methylbutanamide
CID 79811592
N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
CID 119627588
4-[(2-amino-2-methylbutanoyl)amino]-3-hydroxy-3-methylbutanoic acid
CID 79811934
ethyl 2-oxo-2-(2,2,3,3-tetrafluoropropylamino)acetate
CID 106295297
methyl N-(2,2,3,3-tetrafluoropropyl)carbamate
CID 103528765
1-ethyl-1-methyl-3-(2,2,3,3-tetrafluoropropyl)urea
CID 106291111
2-ethoxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 103528809
2-amino-N-(2-hydroxy-4,4-dimethylpentyl)-2-methylbutanamide
CID 107152773
2-sulfanyl-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 106295758
(2R)-2-amino-4-methyl-N-(2,2,3,3-tetrafluoropropyl)pentanamide
CID 106291723
2-amino-N-(2-cyanopropyl)-2-methylbutanamide
CID 79811894

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide?
The IUPAC name of 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide (CID 106291936) is 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide?
The canonical SMILES for 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide is CCC(C)(N)C(=O)NCC(F)(F)C(F)F.
What is the InChIKey of 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide?
The InChIKey is WCHXDEHZIIOTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F4N2O/c1-3-7(2,13)6(15)14-4-8(11,12)5(9)10/h5H,3-4,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide?
2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide has a molecular weight of 230.20 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(2,2,3,3-tetrafluoropropyl)butanamide is sourced from PubChem (CID 106291936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).