2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide

C4H6F3N3O2 — CID 43163996

IUPAC2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide
SMILESNNC(=O)C(=O)NCC(F)(F)F
InChIInChI=1S/C4H6F3N3O2/c5-4(6,7)1-9-2(11)3(12)10-8/h1,8H2,(H,9,11)(H,10,12)
InChIKeyYXAAFRWIPFNTNS-UHFFFAOYSA-N
MW185.10 g/mol
LogP-1.35
Rot. Bonds1

About 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide

2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 43163996) has the molecular formula C4H6F3N3O2 and a molecular weight of 185.10 g/mol. Its IUPAC name is 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID43163996
Molecular FormulaC4H6F3N3O2
Molecular Weight185.10 g/mol
Exact Mass185.04
IUPAC Name2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide
SMILESNNC(=O)C(=O)NCC(F)(F)F
InChIInChI=1S/C4H6F3N3O2/c5-4(6,7)1-9-2(11)3(12)10-8/h1,8H2,(H,9,11)(H,10,12)
InChIKeyYXAAFRWIPFNTNS-UHFFFAOYSA-N
XLogP-1.35
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.10
LogP ≤ 5-1.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide (CID 43163996) is 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide is NNC(=O)C(=O)NCC(F)(F)F.
What is the InChIKey of 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is YXAAFRWIPFNTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F3N3O2/c5-4(6,7)1-9-2(11)3(12)10-8/h1,8H2,(H,9,11)(H,10,12).
What are the key properties of 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide?
2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 185.10 g/mol, XLogP of -1.35, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-2-oxo-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 43163996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).