N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide

C4H8FN3O2 — CID 54063162

IUPACN-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)NCCF
InChIInChI=1S/C4H8FN3O2/c5-1-2-7-3(9)4(10)8-6/h1-2,6H2,(H,7,9)(H,8,10)
InChIKeyMBDVUZRNLDBJJR-UHFFFAOYSA-N
MW149.12 g/mol
LogP-1.94
Rot. Bonds2

About N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide

N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide (PubChem CID 54063162) has the molecular formula C4H8FN3O2 and a molecular weight of 149.12 g/mol. Its IUPAC name is N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide.

Molecular Properties

Compound NameN-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide
PubChem CID54063162
Molecular FormulaC4H8FN3O2
Molecular Weight149.12 g/mol
Exact Mass149.06
IUPAC NameN-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)NCCF
InChIInChI=1S/C4H8FN3O2/c5-1-2-7-3(9)4(10)8-6/h1-2,6H2,(H,7,9)(H,8,10)
InChIKeyMBDVUZRNLDBJJR-UHFFFAOYSA-N
XLogP-1.94
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.12
LogP ≤ 5-1.94
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 N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide?
The IUPAC name of N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide (CID 54063162) is N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide.
What is the SMILES notation for N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide?
The canonical SMILES for N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide is NNC(=O)C(=O)NCCF.
What is the InChIKey of N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide?
The InChIKey is MBDVUZRNLDBJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FN3O2/c5-1-2-7-3(9)4(10)8-6/h1-2,6H2,(H,7,9)(H,8,10).
What are the key properties of N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide?
N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide has a molecular weight of 149.12 g/mol, XLogP of -1.94, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-2-hydrazinyl-2-oxoacetamide is sourced from PubChem (CID 54063162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).