N-(5-oxooxolan-2-yl)acetamide

C6H9NO3 — CID 86011112

IUPACN-(5-oxooxolan-2-yl)acetamide
SMILESCC(=O)NC1CCC(=O)O1
InChIInChI=1S/C6H9NO3/c1-4(8)7-5-2-3-6(9)10-5/h5H,2-3H2,1H3,(H,7,8)
InChIKeyRCRHNGLOCKSMJG-UHFFFAOYSA-N
MW143.14 g/mol
LogP-0.21
Rot. Bonds1

About N-(5-oxooxolan-2-yl)acetamide

N-(5-oxooxolan-2-yl)acetamide (PubChem CID 86011112) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is N-(5-oxooxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-(5-oxooxolan-2-yl)acetamide
PubChem CID86011112
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC NameN-(5-oxooxolan-2-yl)acetamide
SMILESCC(=O)NC1CCC(=O)O1
InChIInChI=1S/C6H9NO3/c1-4(8)7-5-2-3-6(9)10-5/h5H,2-3H2,1H3,(H,7,8)
InChIKeyRCRHNGLOCKSMJG-UHFFFAOYSA-N
XLogP-0.21
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-oxooxolan-2-yl)acetamide?
The IUPAC name of N-(5-oxooxolan-2-yl)acetamide (CID 86011112) is N-(5-oxooxolan-2-yl)acetamide.
What is the SMILES notation for N-(5-oxooxolan-2-yl)acetamide?
The canonical SMILES for N-(5-oxooxolan-2-yl)acetamide is CC(=O)NC1CCC(=O)O1.
What is the InChIKey of N-(5-oxooxolan-2-yl)acetamide?
The InChIKey is RCRHNGLOCKSMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3/c1-4(8)7-5-2-3-6(9)10-5/h5H,2-3H2,1H3,(H,7,8).
What are the key properties of N-(5-oxooxolan-2-yl)acetamide?
N-(5-oxooxolan-2-yl)acetamide has a molecular weight of 143.14 g/mol, XLogP of -0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxooxolan-2-yl)acetamide is sourced from PubChem (CID 86011112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).