2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide

C6H11FN2O3 — CID 130667891

IUPAC2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide
SMILESCC(C)(F)C(=O)NNC(=O)CO
InChIInChI=1S/C6H11FN2O3/c1-6(2,7)5(12)9-8-4(11)3-10/h10H,3H2,1-2H3,(H,8,11)(H,9,12)
InChIKeyQLMRXNMNEUHBGJ-UHFFFAOYSA-N
MW178.16 g/mol
LogP-1.13
Rot. Bonds2

About 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide

2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide (PubChem CID 130667891) has the molecular formula C6H11FN2O3 and a molecular weight of 178.16 g/mol. Its IUPAC name is 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide.

Molecular Properties

Compound Name2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide
PubChem CID130667891
Molecular FormulaC6H11FN2O3
Molecular Weight178.16 g/mol
Exact Mass178.08
IUPAC Name2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide
SMILESCC(C)(F)C(=O)NNC(=O)CO
InChIInChI=1S/C6H11FN2O3/c1-6(2,7)5(12)9-8-4(11)3-10/h10H,3H2,1-2H3,(H,8,11)(H,9,12)
InChIKeyQLMRXNMNEUHBGJ-UHFFFAOYSA-N
XLogP-1.13
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.16
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide?
The IUPAC name of 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide (CID 130667891) is 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide.
What is the SMILES notation for 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide?
The canonical SMILES for 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide is CC(C)(F)C(=O)NNC(=O)CO.
What is the InChIKey of 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide?
The InChIKey is QLMRXNMNEUHBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FN2O3/c1-6(2,7)5(12)9-8-4(11)3-10/h10H,3H2,1-2H3,(H,8,11)(H,9,12).
What are the key properties of 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide?
2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide has a molecular weight of 178.16 g/mol, XLogP of -1.13, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N'-(2-hydroxyacetyl)-2-methylpropanehydrazide is sourced from PubChem (CID 130667891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).