2-(oxetan-3-yl)acetamide

C5H9NO2 — CID 67125854

IUPAC2-(oxetan-3-yl)acetamide
SMILESNC(=O)CC1COC1
InChIInChI=1S/C5H9NO2/c6-5(7)1-4-2-8-3-4/h4H,1-3H2,(H2,6,7)
InChIKeyUNBYNGXMMGGSAL-UHFFFAOYSA-N
MW115.13 g/mol
LogP-0.49
Rot. Bonds2

About 2-(oxetan-3-yl)acetamide

2-(oxetan-3-yl)acetamide (PubChem CID 67125854) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is 2-(oxetan-3-yl)acetamide.

Molecular Properties

Compound Name2-(oxetan-3-yl)acetamide
PubChem CID67125854
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name2-(oxetan-3-yl)acetamide
SMILESNC(=O)CC1COC1
InChIInChI=1S/C5H9NO2/c6-5(7)1-4-2-8-3-4/h4H,1-3H2,(H2,6,7)
InChIKeyUNBYNGXMMGGSAL-UHFFFAOYSA-N
XLogP-0.49
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(oxetan-3-yl)acetamide?
The IUPAC name of 2-(oxetan-3-yl)acetamide (CID 67125854) is 2-(oxetan-3-yl)acetamide.
What is the SMILES notation for 2-(oxetan-3-yl)acetamide?
The canonical SMILES for 2-(oxetan-3-yl)acetamide is NC(=O)CC1COC1.
What is the InChIKey of 2-(oxetan-3-yl)acetamide?
The InChIKey is UNBYNGXMMGGSAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2/c6-5(7)1-4-2-8-3-4/h4H,1-3H2,(H2,6,7).
What are the key properties of 2-(oxetan-3-yl)acetamide?
2-(oxetan-3-yl)acetamide has a molecular weight of 115.13 g/mol, XLogP of -0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxetan-3-yl)acetamide is sourced from PubChem (CID 67125854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).