2-(trideuteriomethyl)azetidine

C4H9N — CID 126456233

IUPAC2-(trideuteriomethyl)azetidine
SMILES[2H]C([2H])([2H])C1CCN1
InChIInChI=1S/C4H9N/c1-4-2-3-5-4/h4-5H,2-3H2,1H3/i1D3
InChIKeyDLBWPRNUXWYLRN-FIBGUPNXSA-N
MW74.14 g/mol
LogP0.37
Rot. Bonds1

About 2-(trideuteriomethyl)azetidine

2-(trideuteriomethyl)azetidine (PubChem CID 126456233) has the molecular formula C4H9N and a molecular weight of 74.14 g/mol. Its IUPAC name is 2-(trideuteriomethyl)azetidine.

Molecular Properties

Compound Name2-(trideuteriomethyl)azetidine
PubChem CID126456233
Molecular FormulaC4H9N
Molecular Weight74.14 g/mol
Exact Mass74.09
IUPAC Name2-(trideuteriomethyl)azetidine
SMILES[2H]C([2H])([2H])C1CCN1
InChIInChI=1S/C4H9N/c1-4-2-3-5-4/h4-5H,2-3H2,1H3/i1D3
InChIKeyDLBWPRNUXWYLRN-FIBGUPNXSA-N
XLogP0.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.14
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(trideuteriomethyl)azetidine?
The IUPAC name of 2-(trideuteriomethyl)azetidine (CID 126456233) is 2-(trideuteriomethyl)azetidine.
What is the SMILES notation for 2-(trideuteriomethyl)azetidine?
The canonical SMILES for 2-(trideuteriomethyl)azetidine is [2H]C([2H])([2H])C1CCN1.
What is the InChIKey of 2-(trideuteriomethyl)azetidine?
The InChIKey is DLBWPRNUXWYLRN-FIBGUPNXSA-N. The full InChI is InChI=1S/C4H9N/c1-4-2-3-5-4/h4-5H,2-3H2,1H3/i1D3.
What are the key properties of 2-(trideuteriomethyl)azetidine?
2-(trideuteriomethyl)azetidine has a molecular weight of 74.14 g/mol, XLogP of 0.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trideuteriomethyl)azetidine is sourced from PubChem (CID 126456233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).