(2S)-2-(2,2-dimethylpropoxy)azetidine

C8H17NO — CID 139527738

IUPAC(2S)-2-(2,2-dimethylpropoxy)azetidine
SMILESCC(C)(C)CO[C@H]1CCN1
InChIInChI=1S/C8H17NO/c1-8(2,3)6-10-7-4-5-9-7/h7,9H,4-6H2,1-3H3/t7-/m0/s1
InChIKeyVJLKGCMGTMCNKN-ZETCQYMHSA-N
MW143.23 g/mol
LogP1.37
Rot. Bonds2

About (2S)-2-(2,2-dimethylpropoxy)azetidine

(2S)-2-(2,2-dimethylpropoxy)azetidine (PubChem CID 139527738) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2S)-2-(2,2-dimethylpropoxy)azetidine.

Molecular Properties

Compound Name(2S)-2-(2,2-dimethylpropoxy)azetidine
PubChem CID139527738
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2S)-2-(2,2-dimethylpropoxy)azetidine
SMILESCC(C)(C)CO[C@H]1CCN1
InChIInChI=1S/C8H17NO/c1-8(2,3)6-10-7-4-5-9-7/h7,9H,4-6H2,1-3H3/t7-/m0/s1
InChIKeyVJLKGCMGTMCNKN-ZETCQYMHSA-N
XLogP1.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2,2-dimethylpropoxy)azetidine?
The IUPAC name of (2S)-2-(2,2-dimethylpropoxy)azetidine (CID 139527738) is (2S)-2-(2,2-dimethylpropoxy)azetidine.
What is the SMILES notation for (2S)-2-(2,2-dimethylpropoxy)azetidine?
The canonical SMILES for (2S)-2-(2,2-dimethylpropoxy)azetidine is CC(C)(C)CO[C@H]1CCN1.
What is the InChIKey of (2S)-2-(2,2-dimethylpropoxy)azetidine?
The InChIKey is VJLKGCMGTMCNKN-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H17NO/c1-8(2,3)6-10-7-4-5-9-7/h7,9H,4-6H2,1-3H3/t7-/m0/s1.
What are the key properties of (2S)-2-(2,2-dimethylpropoxy)azetidine?
(2S)-2-(2,2-dimethylpropoxy)azetidine has a molecular weight of 143.23 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2,2-dimethylpropoxy)azetidine is sourced from PubChem (CID 139527738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).