N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide

C11H10F4N2O2 — CID 103732853

IUPACN-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide
SMILESNC(=O)Cc1ccccc1NC(=O)C(F)(F)C(F)F
InChIInChI=1S/C11H10F4N2O2/c12-9(13)11(14,15)10(19)17-7-4-2-1-3-6(7)5-8(16)18/h1-4,9H,5H2,(H2,16,18)(H,17,19)
InChIKeyACNLAWANRUTOIB-UHFFFAOYSA-N
MW278.20 g/mol
LogP1.55
Rot. Bonds5

About N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide

N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide (PubChem CID 103732853) has the molecular formula C11H10F4N2O2 and a molecular weight of 278.20 g/mol. Its IUPAC name is N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide.

Molecular Properties

Compound NameN-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide
PubChem CID103732853
Molecular FormulaC11H10F4N2O2
Molecular Weight278.20 g/mol
Exact Mass278.07
IUPAC NameN-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide
SMILESNC(=O)Cc1ccccc1NC(=O)C(F)(F)C(F)F
InChIInChI=1S/C11H10F4N2O2/c12-9(13)11(14,15)10(19)17-7-4-2-1-3-6(7)5-8(16)18/h1-4,9H,5H2,(H2,16,18)(H,17,19)
InChIKeyACNLAWANRUTOIB-UHFFFAOYSA-N
XLogP1.55
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.20
LogP ≤ 51.55
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

N-[2-(2-amino-2-oxoethyl)phenyl]-2-bromo-2-methylpropanamide
CID 114327737
2-(aminomethyl)-N-[2-(2-amino-2-oxoethyl)phenyl]-2-ethylbutanamide
CID 115431675
N-[2-(difluoromethoxy)phenyl]-2,2,3,3-tetrafluoropropanamide
CID 103732374
2,2,3,3-tetrafluoro-N-[2-(trifluoromethoxy)phenyl]propanamide
CID 103732361
N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
CID 86929205
2,2,3,3-tetrafluoro-N-[2-(2-methylpropoxy)phenyl]propanamide
CID 103733060
N-[2-[[2-(2-amino-2-oxoethyl)phenyl]carbamoylamino]ethyl]-2-methylpropanamide
CID 51080425
N-[2-(2-amino-2-oxoethyl)phenyl]-2-bromobutanamide
CID 62856321
2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide
CID 90271537
2,2,3,3-tetrafluoro-N-(2-pyrazol-1-ylphenyl)propanamide
CID 103732765
N-(3-bromo-2-methylphenyl)-2,2,3,3-tetrafluoropropanamide
CID 103733456
2,2,3,3-tetrafluoro-N-[2-(triazol-1-yl)phenyl]propanamide
CID 103737699

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide?
The IUPAC name of N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide (CID 103732853) is N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide.
What is the SMILES notation for N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide?
The canonical SMILES for N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide is NC(=O)Cc1ccccc1NC(=O)C(F)(F)C(F)F.
What is the InChIKey of N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide?
The InChIKey is ACNLAWANRUTOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F4N2O2/c12-9(13)11(14,15)10(19)17-7-4-2-1-3-6(7)5-8(16)18/h1-4,9H,5H2,(H2,16,18)(H,17,19).
What are the key properties of N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide?
N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide has a molecular weight of 278.20 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide is sourced from PubChem (CID 103732853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).