sodium;(2-aminofuran-3-yl) acetate;hydride

C6H8NNaO3 — CID 173459776

IUPACsodium;(2-aminofuran-3-yl) acetate;hydride
SMILESCC(=O)Oc1ccoc1N.[H-].[Na+]
InChIInChI=1S/C6H7NO3.Na.H/c1-4(8)10-5-2-3-9-6(5)7;;/h2-3H,7H2,1H3;;/q;+1;-1
InChIKeyCZFZJAOENOVYGT-UHFFFAOYSA-N
MW165.12 g/mol
LogP-2.10
Rot. Bonds1

About sodium;(2-aminofuran-3-yl) acetate;hydride

sodium;(2-aminofuran-3-yl) acetate;hydride (PubChem CID 173459776) has the molecular formula C6H8NNaO3 and a molecular weight of 165.12 g/mol. Its IUPAC name is sodium;(2-aminofuran-3-yl) acetate;hydride.

Molecular Properties

Compound Namesodium;(2-aminofuran-3-yl) acetate;hydride
PubChem CID173459776
Molecular FormulaC6H8NNaO3
Molecular Weight165.12 g/mol
Exact Mass165.04
IUPAC Namesodium;(2-aminofuran-3-yl) acetate;hydride
SMILESCC(=O)Oc1ccoc1N.[H-].[Na+]
InChIInChI=1S/C6H7NO3.Na.H/c1-4(8)10-5-2-3-9-6(5)7;;/h2-3H,7H2,1H3;;/q;+1;-1
InChIKeyCZFZJAOENOVYGT-UHFFFAOYSA-N
XLogP-2.10
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.12
LogP ≤ 5-2.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of sodium;(2-aminofuran-3-yl) acetate;hydride?
The IUPAC name of sodium;(2-aminofuran-3-yl) acetate;hydride (CID 173459776) is sodium;(2-aminofuran-3-yl) acetate;hydride.
What is the SMILES notation for sodium;(2-aminofuran-3-yl) acetate;hydride?
The canonical SMILES for sodium;(2-aminofuran-3-yl) acetate;hydride is CC(=O)Oc1ccoc1N.[H-].[Na+].
What is the InChIKey of sodium;(2-aminofuran-3-yl) acetate;hydride?
The InChIKey is CZFZJAOENOVYGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO3.Na.H/c1-4(8)10-5-2-3-9-6(5)7;;/h2-3H,7H2,1H3;;/q;+1;-1.
What are the key properties of sodium;(2-aminofuran-3-yl) acetate;hydride?
sodium;(2-aminofuran-3-yl) acetate;hydride has a molecular weight of 165.12 g/mol, XLogP of -2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;(2-aminofuran-3-yl) acetate;hydride is sourced from PubChem (CID 173459776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).