N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide

C10H16F4N2O2 — CID 103732251

IUPACN-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide
SMILESCN(CC(=O)NC(C)(C)C)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H16F4N2O2/c1-9(2,3)15-6(17)5-16(4)8(18)10(13,14)7(11)12/h7H,5H2,1-4H3,(H,15,17)
InChIKeyAJSFJUALQYQOBM-UHFFFAOYSA-N
MW272.24 g/mol
LogP1.26
Rot. Bonds4

About N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide

N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide (PubChem CID 103732251) has the molecular formula C10H16F4N2O2 and a molecular weight of 272.24 g/mol. Its IUPAC name is N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide.

Molecular Properties

Compound NameN-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide
PubChem CID103732251
Molecular FormulaC10H16F4N2O2
Molecular Weight272.24 g/mol
Exact Mass272.11
IUPAC NameN-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide
SMILESCN(CC(=O)NC(C)(C)C)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H16F4N2O2/c1-9(2,3)15-6(17)5-16(4)8(18)10(13,14)7(11)12/h7H,5H2,1-4H3,(H,15,17)
InChIKeyAJSFJUALQYQOBM-UHFFFAOYSA-N
XLogP1.26
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.24
LogP ≤ 51.26
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

2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide
CID 103755692
(Z)-4-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 55167926
(2R)-N-[2-(tert-butylamino)-2-oxoethyl]-2-chloro-N-methylpropanamide
CID 93317901
N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
CID 113250804
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-3-oxobutanamide
CID 60951663
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(2,2,2-trifluoroethoxy)propanamide
CID 86985517
2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
CID 103732271
N-[2-(tert-butylamino)-2-oxoethyl]-N-methylbutanamide
CID 60717641
N-[2-(tert-butylamino)-2-oxoethyl]-N-methylbut-2-enamide
CID 112725202
4-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methylbutanamide
CID 60936943
6-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-6-oxohexanoic acid
CID 54874830
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-propan-2-ylacetamide
CID 86908596

Frequently Asked Questions

What is the IUPAC name of N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide?
The IUPAC name of N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide (CID 103732251) is N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide.
What is the SMILES notation for N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide?
The canonical SMILES for N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide is CN(CC(=O)NC(C)(C)C)C(=O)C(F)(F)C(F)F.
What is the InChIKey of N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide?
The InChIKey is AJSFJUALQYQOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F4N2O2/c1-9(2,3)15-6(17)5-16(4)8(18)10(13,14)7(11)12/h7H,5H2,1-4H3,(H,15,17).
What are the key properties of N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide?
N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide has a molecular weight of 272.24 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoro-N-methylpropanamide is sourced from PubChem (CID 103732251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).