(3R)-2,3-dimethylazetidine

C5H11N — CID 154523082

IUPAC(3R)-2,3-dimethylazetidine
SMILESCC1NC[C@H]1C
InChIInChI=1S/C5H11N/c1-4-3-6-5(4)2/h4-6H,3H2,1-2H3/t4-,5?/m1/s1
InChIKeyBMVHDBKYVGUEIX-CNZKWPKMSA-N
MW85.15 g/mol
LogP0.61
Rot. Bonds

About (3R)-2,3-dimethylazetidine

(3R)-2,3-dimethylazetidine (PubChem CID 154523082) has the molecular formula C5H11N and a molecular weight of 85.15 g/mol. Its IUPAC name is (3R)-2,3-dimethylazetidine.

Molecular Properties

Compound Name(3R)-2,3-dimethylazetidine
PubChem CID154523082
Molecular FormulaC5H11N
Molecular Weight85.15 g/mol
Exact Mass85.09
IUPAC Name(3R)-2,3-dimethylazetidine
SMILESCC1NC[C@H]1C
InChIInChI=1S/C5H11N/c1-4-3-6-5(4)2/h4-6H,3H2,1-2H3/t4-,5?/m1/s1
InChIKeyBMVHDBKYVGUEIX-CNZKWPKMSA-N
XLogP0.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.15
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-2,3-dimethylazetidine?
The IUPAC name of (3R)-2,3-dimethylazetidine (CID 154523082) is (3R)-2,3-dimethylazetidine.
What is the SMILES notation for (3R)-2,3-dimethylazetidine?
The canonical SMILES for (3R)-2,3-dimethylazetidine is CC1NC[C@H]1C.
What is the InChIKey of (3R)-2,3-dimethylazetidine?
The InChIKey is BMVHDBKYVGUEIX-CNZKWPKMSA-N. The full InChI is InChI=1S/C5H11N/c1-4-3-6-5(4)2/h4-6H,3H2,1-2H3/t4-,5?/m1/s1.
What are the key properties of (3R)-2,3-dimethylazetidine?
(3R)-2,3-dimethylazetidine has a molecular weight of 85.15 g/mol, XLogP of 0.61, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2,3-dimethylazetidine is sourced from PubChem (CID 154523082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).