2-(5-oxo-2H-furan-3-yl)acetamide

C6H7NO3 — CID 70050239

IUPAC2-(5-oxo-2H-furan-3-yl)acetamide
SMILESNC(=O)CC1=CC(=O)OC1
InChIInChI=1S/C6H7NO3/c7-5(8)1-4-2-6(9)10-3-4/h2H,1,3H2,(H2,7,8)
InChIKeyUNMHXQDFHFJDCB-UHFFFAOYSA-N
MW141.13 g/mol
LogP-0.65
Rot. Bonds2

About 2-(5-oxo-2H-furan-3-yl)acetamide

2-(5-oxo-2H-furan-3-yl)acetamide (PubChem CID 70050239) has the molecular formula C6H7NO3 and a molecular weight of 141.13 g/mol. Its IUPAC name is 2-(5-oxo-2H-furan-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-oxo-2H-furan-3-yl)acetamide
PubChem CID70050239
Molecular FormulaC6H7NO3
Molecular Weight141.13 g/mol
Exact Mass141.04
IUPAC Name2-(5-oxo-2H-furan-3-yl)acetamide
SMILESNC(=O)CC1=CC(=O)OC1
InChIInChI=1S/C6H7NO3/c7-5(8)1-4-2-6(9)10-3-4/h2H,1,3H2,(H2,7,8)
InChIKeyUNMHXQDFHFJDCB-UHFFFAOYSA-N
XLogP-0.65
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 5-0.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-oxo-2H-furan-3-yl)acetamide?
The IUPAC name of 2-(5-oxo-2H-furan-3-yl)acetamide (CID 70050239) is 2-(5-oxo-2H-furan-3-yl)acetamide.
What is the SMILES notation for 2-(5-oxo-2H-furan-3-yl)acetamide?
The canonical SMILES for 2-(5-oxo-2H-furan-3-yl)acetamide is NC(=O)CC1=CC(=O)OC1.
What is the InChIKey of 2-(5-oxo-2H-furan-3-yl)acetamide?
The InChIKey is UNMHXQDFHFJDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO3/c7-5(8)1-4-2-6(9)10-3-4/h2H,1,3H2,(H2,7,8).
What are the key properties of 2-(5-oxo-2H-furan-3-yl)acetamide?
2-(5-oxo-2H-furan-3-yl)acetamide has a molecular weight of 141.13 g/mol, XLogP of -0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-oxo-2H-furan-3-yl)acetamide is sourced from PubChem (CID 70050239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).