2-methylpropan-2-ol;oxazetidine

C6H15NO2 — CID 174742214

IUPAC2-methylpropan-2-ol;oxazetidine
SMILESC1CON1.CC(C)(C)O
InChIInChI=1S/C4H10O.C2H5NO/c1-4(2,3)5;1-2-4-3-1/h5H,1-3H3;3H,1-2H2
InChIKeyHEBJARANVIJHKZ-UHFFFAOYSA-N
MW133.19 g/mol
LogP0.30
Rot. Bonds

About 2-methylpropan-2-ol;oxazetidine

2-methylpropan-2-ol;oxazetidine (PubChem CID 174742214) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 2-methylpropan-2-ol;oxazetidine.

Molecular Properties

Compound Name2-methylpropan-2-ol;oxazetidine
PubChem CID174742214
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name2-methylpropan-2-ol;oxazetidine
SMILESC1CON1.CC(C)(C)O
InChIInChI=1S/C4H10O.C2H5NO/c1-4(2,3)5;1-2-4-3-1/h5H,1-3H3;3H,1-2H2
InChIKeyHEBJARANVIJHKZ-UHFFFAOYSA-N
XLogP0.30
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropan-2-ol;oxazetidine?
The IUPAC name of 2-methylpropan-2-ol;oxazetidine (CID 174742214) is 2-methylpropan-2-ol;oxazetidine.
What is the SMILES notation for 2-methylpropan-2-ol;oxazetidine?
The canonical SMILES for 2-methylpropan-2-ol;oxazetidine is C1CON1.CC(C)(C)O.
What is the InChIKey of 2-methylpropan-2-ol;oxazetidine?
The InChIKey is HEBJARANVIJHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C2H5NO/c1-4(2,3)5;1-2-4-3-1/h5H,1-3H3;3H,1-2H2.
What are the key properties of 2-methylpropan-2-ol;oxazetidine?
2-methylpropan-2-ol;oxazetidine has a molecular weight of 133.19 g/mol, XLogP of 0.30, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropan-2-ol;oxazetidine is sourced from PubChem (CID 174742214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).