propan-2-yl 2-(fluoroamino)acetate

C5H10FNO2 — CID 89108971

IUPACpropan-2-yl 2-(fluoroamino)acetate
SMILESCC(C)OC(=O)CNF
InChIInChI=1S/C5H10FNO2/c1-4(2)9-5(8)3-7-6/h4,7H,3H2,1-2H3
InChIKeyUDCCRRWSWISYPH-UHFFFAOYSA-N
MW135.14 g/mol
LogP0.41
Rot. Bonds3

About propan-2-yl 2-(fluoroamino)acetate

propan-2-yl 2-(fluoroamino)acetate (PubChem CID 89108971) has the molecular formula C5H10FNO2 and a molecular weight of 135.14 g/mol. Its IUPAC name is propan-2-yl 2-(fluoroamino)acetate.

Molecular Properties

Compound Namepropan-2-yl 2-(fluoroamino)acetate
PubChem CID89108971
Molecular FormulaC5H10FNO2
Molecular Weight135.14 g/mol
Exact Mass135.07
IUPAC Namepropan-2-yl 2-(fluoroamino)acetate
SMILESCC(C)OC(=O)CNF
InChIInChI=1S/C5H10FNO2/c1-4(2)9-5(8)3-7-6/h4,7H,3H2,1-2H3
InChIKeyUDCCRRWSWISYPH-UHFFFAOYSA-N
XLogP0.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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[(2-oxo-2-propan-2-yloxyethyl)amino]methylphosphonic acid
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propan-2-yl 2-(2-methylsulfanylethylamino)acetate
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CID 115356445
propan-2-yl (4R)-4,5-dimethyl-3-oxohexanoate
CID 58957795
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Frequently Asked Questions

What is the IUPAC name of propan-2-yl 2-(fluoroamino)acetate?
The IUPAC name of propan-2-yl 2-(fluoroamino)acetate (CID 89108971) is propan-2-yl 2-(fluoroamino)acetate.
What is the SMILES notation for propan-2-yl 2-(fluoroamino)acetate?
The canonical SMILES for propan-2-yl 2-(fluoroamino)acetate is CC(C)OC(=O)CNF.
What is the InChIKey of propan-2-yl 2-(fluoroamino)acetate?
The InChIKey is UDCCRRWSWISYPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO2/c1-4(2)9-5(8)3-7-6/h4,7H,3H2,1-2H3.
What are the key properties of propan-2-yl 2-(fluoroamino)acetate?
propan-2-yl 2-(fluoroamino)acetate has a molecular weight of 135.14 g/mol, XLogP of 0.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 2-(fluoroamino)acetate is sourced from PubChem (CID 89108971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).