(2R)-2-ethenyl-1-methylazetidine

C6H11N — CID 174077696

IUPAC(2R)-2-ethenyl-1-methylazetidine
SMILESC=C[C@H]1CCN1C
InChIInChI=1S/C6H11N/c1-3-6-4-5-7(6)2/h3,6H,1,4-5H2,2H3/t6-/m0/s1
InChIKeyMYVYGIHNALZQFO-LURJTMIESA-N
MW97.16 g/mol
LogP0.88
Rot. Bonds1

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

(2R)-2-ethenyl-1-methylazetidine (PubChem CID 174077696) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is (2R)-2-ethenyl-1-methylazetidine.

Molecular Properties

Compound Name(2R)-2-ethenyl-1-methylazetidine
PubChem CID174077696
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Name(2R)-2-ethenyl-1-methylazetidine
SMILESC=C[C@H]1CCN1C
InChIInChI=1S/C6H11N/c1-3-6-4-5-7(6)2/h3,6H,1,4-5H2,2H3/t6-/m0/s1
InChIKeyMYVYGIHNALZQFO-LURJTMIESA-N
XLogP0.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethenyl-1-methylazetidine?
The IUPAC name of (2R)-2-ethenyl-1-methylazetidine (CID 174077696) is (2R)-2-ethenyl-1-methylazetidine.
What is the SMILES notation for (2R)-2-ethenyl-1-methylazetidine?
The canonical SMILES for (2R)-2-ethenyl-1-methylazetidine is C=C[C@H]1CCN1C.
What is the InChIKey of (2R)-2-ethenyl-1-methylazetidine?
The InChIKey is MYVYGIHNALZQFO-LURJTMIESA-N. The full InChI is InChI=1S/C6H11N/c1-3-6-4-5-7(6)2/h3,6H,1,4-5H2,2H3/t6-/m0/s1.
What are the key properties of (2R)-2-ethenyl-1-methylazetidine?
(2R)-2-ethenyl-1-methylazetidine has a molecular weight of 97.16 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethenyl-1-methylazetidine is sourced from PubChem (CID 174077696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).