(2R)-1-bromo-2-methylazetidine

C4H8BrN — CID 134925898

IUPAC(2R)-1-bromo-2-methylazetidine
SMILESC[C@@H]1CCN1Br
InChIInChI=1S/C4H8BrN/c1-4-2-3-6(4)5/h4H,2-3H2,1H3/t4-/m1/s1
InChIKeyZWXSTDVHCOZIKS-SCSAIBSYSA-N
MW150.02 g/mol
LogP1.39
Rot. Bonds

About (2R)-1-bromo-2-methylazetidine

(2R)-1-bromo-2-methylazetidine (PubChem CID 134925898) has the molecular formula C4H8BrN and a molecular weight of 150.02 g/mol. Its IUPAC name is (2R)-1-bromo-2-methylazetidine.

Molecular Properties

Compound Name(2R)-1-bromo-2-methylazetidine
PubChem CID134925898
Molecular FormulaC4H8BrN
Molecular Weight150.02 g/mol
Exact Mass148.98
IUPAC Name(2R)-1-bromo-2-methylazetidine
SMILESC[C@@H]1CCN1Br
InChIInChI=1S/C4H8BrN/c1-4-2-3-6(4)5/h4H,2-3H2,1H3/t4-/m1/s1
InChIKeyZWXSTDVHCOZIKS-SCSAIBSYSA-N
XLogP1.39
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.02
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-bromo-2-methylazetidine?
The IUPAC name of (2R)-1-bromo-2-methylazetidine (CID 134925898) is (2R)-1-bromo-2-methylazetidine.
What is the SMILES notation for (2R)-1-bromo-2-methylazetidine?
The canonical SMILES for (2R)-1-bromo-2-methylazetidine is C[C@@H]1CCN1Br.
What is the InChIKey of (2R)-1-bromo-2-methylazetidine?
The InChIKey is ZWXSTDVHCOZIKS-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H8BrN/c1-4-2-3-6(4)5/h4H,2-3H2,1H3/t4-/m1/s1.
What are the key properties of (2R)-1-bromo-2-methylazetidine?
(2R)-1-bromo-2-methylazetidine has a molecular weight of 150.02 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-bromo-2-methylazetidine is sourced from PubChem (CID 134925898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).