N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide

C10H10F3N3O3 — CID 166385998

IUPACN-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide
SMILESO=CNCC(=O)NNc1ccccc1OC(F)(F)F
InChIInChI=1S/C10H10F3N3O3/c11-10(12,13)19-8-4-2-1-3-7(8)15-16-9(18)5-14-6-17/h1-4,6,15H,5H2,(H,14,17)(H,16,18)
InChIKeyASFXTCNJGKEYCA-UHFFFAOYSA-N
MW277.20 g/mol
LogP0.77
Rot. Bonds6

About N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide

N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide (PubChem CID 166385998) has the molecular formula C10H10F3N3O3 and a molecular weight of 277.20 g/mol. Its IUPAC name is N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide.

Molecular Properties

Compound NameN-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide
PubChem CID166385998
Molecular FormulaC10H10F3N3O3
Molecular Weight277.20 g/mol
Exact Mass277.07
IUPAC NameN-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide
SMILESO=CNCC(=O)NNc1ccccc1OC(F)(F)F
InChIInChI=1S/C10H10F3N3O3/c11-10(12,13)19-8-4-2-1-3-7(8)15-16-9(18)5-14-6-17/h1-4,6,15H,5H2,(H,14,17)(H,16,18)
InChIKeyASFXTCNJGKEYCA-UHFFFAOYSA-N
XLogP0.77
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.20
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide?
The IUPAC name of N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide (CID 166385998) is N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide.
What is the SMILES notation for N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide?
The canonical SMILES for N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide is O=CNCC(=O)NNc1ccccc1OC(F)(F)F.
What is the InChIKey of N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide?
The InChIKey is ASFXTCNJGKEYCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N3O3/c11-10(12,13)19-8-4-2-1-3-7(8)15-16-9(18)5-14-6-17/h1-4,6,15H,5H2,(H,14,17)(H,16,18).
What are the key properties of N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide?
N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide has a molecular weight of 277.20 g/mol, XLogP of 0.77, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[2-[2-(trifluoromethoxy)phenyl]hydrazinyl]ethyl]formamide is sourced from PubChem (CID 166385998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).