2-aminoacetic acid;furan-2-ol

C6H9NO4 — CID 90119571

IUPAC2-aminoacetic acid;furan-2-ol
SMILESNCC(=O)O.Oc1ccco1
InChIInChI=1S/C4H4O2.C2H5NO2/c5-4-2-1-3-6-4;3-1-2(4)5/h1-3,5H;1,3H2,(H,4,5)
InChIKeyWPUXBQPKYLWTJQ-UHFFFAOYSA-N
MW159.14 g/mol
LogP0.01
Rot. Bonds1

About 2-aminoacetic acid;furan-2-ol

2-aminoacetic acid;furan-2-ol (PubChem CID 90119571) has the molecular formula C6H9NO4 and a molecular weight of 159.14 g/mol. Its IUPAC name is 2-aminoacetic acid;furan-2-ol.

Molecular Properties

Compound Name2-aminoacetic acid;furan-2-ol
PubChem CID90119571
Molecular FormulaC6H9NO4
Molecular Weight159.14 g/mol
Exact Mass159.05
IUPAC Name2-aminoacetic acid;furan-2-ol
SMILESNCC(=O)O.Oc1ccco1
InChIInChI=1S/C4H4O2.C2H5NO2/c5-4-2-1-3-6-4;3-1-2(4)5/h1-3,5H;1,3H2,(H,4,5)
InChIKeyWPUXBQPKYLWTJQ-UHFFFAOYSA-N
XLogP0.01
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;furan-2-ol?
The IUPAC name of 2-aminoacetic acid;furan-2-ol (CID 90119571) is 2-aminoacetic acid;furan-2-ol.
What is the SMILES notation for 2-aminoacetic acid;furan-2-ol?
The canonical SMILES for 2-aminoacetic acid;furan-2-ol is NCC(=O)O.Oc1ccco1.
What is the InChIKey of 2-aminoacetic acid;furan-2-ol?
The InChIKey is WPUXBQPKYLWTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4O2.C2H5NO2/c5-4-2-1-3-6-4;3-1-2(4)5/h1-3,5H;1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;furan-2-ol?
2-aminoacetic acid;furan-2-ol has a molecular weight of 159.14 g/mol, XLogP of 0.01, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;furan-2-ol is sourced from PubChem (CID 90119571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).