N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide

C8H10F4N2O2 — CID 103732155

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
SMILESO=C(CNC(=O)C(F)(F)C(F)F)NC1CC1
InChIInChI=1S/C8H10F4N2O2/c9-6(10)8(11,12)7(16)13-3-5(15)14-4-1-2-4/h4,6H,1-3H2,(H,13,16)(H,14,15)
InChIKeyOHTGDHMNOLULFM-UHFFFAOYSA-N
MW242.17 g/mol
LogP0.28
Rot. Bonds5

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

N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide (PubChem CID 103732155) has the molecular formula C8H10F4N2O2 and a molecular weight of 242.17 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
PubChem CID103732155
Molecular FormulaC8H10F4N2O2
Molecular Weight242.17 g/mol
Exact Mass242.07
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
SMILESO=C(CNC(=O)C(F)(F)C(F)F)NC1CC1
InChIInChI=1S/C8H10F4N2O2/c9-6(10)8(11,12)7(16)13-3-5(15)14-4-1-2-4/h4,6H,1-3H2,(H,13,16)(H,14,15)
InChIKeyOHTGDHMNOLULFM-UHFFFAOYSA-N
XLogP0.28
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.17
LogP ≤ 50.28
H-Bond Donors ≤ 52
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 N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide (CID 103732155) is N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide is O=C(CNC(=O)C(F)(F)C(F)F)NC1CC1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide?
The InChIKey is OHTGDHMNOLULFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F4N2O2/c9-6(10)8(11,12)7(16)13-3-5(15)14-4-1-2-4/h4,6H,1-3H2,(H,13,16)(H,14,15).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide has a molecular weight of 242.17 g/mol, XLogP of 0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide is sourced from PubChem (CID 103732155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).