(2R,3R)-1-tert-butyl-2-methylazetidin-3-ol

C8H17NO — CID 14921394

IUPAC(2R,3R)-1-tert-butyl-2-methylazetidin-3-ol
SMILESC[C@@H]1[C@H](O)CN1C(C)(C)C
InChIInChI=1S/C8H17NO/c1-6-7(10)5-9(6)8(2,3)4/h6-7,10H,5H2,1-4H3/t6-,7-/m1/s1
InChIKeyXIKNVZCYMOPOSS-RNFRBKRXSA-N
MW143.23 g/mol
LogP0.85
Rot. Bonds

About (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol

(2R,3R)-1-tert-butyl-2-methylazetidin-3-ol (PubChem CID 14921394) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol.

Molecular Properties

Compound Name(2R,3R)-1-tert-butyl-2-methylazetidin-3-ol
PubChem CID14921394
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2R,3R)-1-tert-butyl-2-methylazetidin-3-ol
SMILESC[C@@H]1[C@H](O)CN1C(C)(C)C
InChIInChI=1S/C8H17NO/c1-6-7(10)5-9(6)8(2,3)4/h6-7,10H,5H2,1-4H3/t6-,7-/m1/s1
InChIKeyXIKNVZCYMOPOSS-RNFRBKRXSA-N
XLogP0.85
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol?
The IUPAC name of (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol (CID 14921394) is (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol.
What is the SMILES notation for (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol?
The canonical SMILES for (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol is C[C@@H]1[C@H](O)CN1C(C)(C)C.
What is the InChIKey of (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol?
The InChIKey is XIKNVZCYMOPOSS-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H17NO/c1-6-7(10)5-9(6)8(2,3)4/h6-7,10H,5H2,1-4H3/t6-,7-/m1/s1.
What are the key properties of (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol?
(2R,3R)-1-tert-butyl-2-methylazetidin-3-ol has a molecular weight of 143.23 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-1-tert-butyl-2-methylazetidin-3-ol is sourced from PubChem (CID 14921394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).