azetidine;ethene

C5H11N — CID 144929598

IUPACazetidine;ethene
SMILESC1CNC1.C=C
InChIInChI=1S/C3H7N.C2H4/c1-2-4-3-1;1-2/h4H,1-3H2;1-2H2
InChIKeyDDCZVLLNFISFJW-UHFFFAOYSA-N
MW85.15 g/mol
LogP0.78
Rot. Bonds

About azetidine;ethene

azetidine;ethene (PubChem CID 144929598) has the molecular formula C5H11N and a molecular weight of 85.15 g/mol. Its IUPAC name is azetidine;ethene.

Molecular Properties

Compound Nameazetidine;ethene
PubChem CID144929598
Molecular FormulaC5H11N
Molecular Weight85.15 g/mol
Exact Mass85.09
IUPAC Nameazetidine;ethene
SMILESC1CNC1.C=C
InChIInChI=1S/C3H7N.C2H4/c1-2-4-3-1;1-2/h4H,1-3H2;1-2H2
InChIKeyDDCZVLLNFISFJW-UHFFFAOYSA-N
XLogP0.78
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 ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Azetidine;ethane
CID 54363748
Azetidine;methane
CID 67244309
Azetidine;propane
CID 91117191
Azetidine;butane;ethane;ethene
CID 145230947
Azetidine;ethane;molecular hydrogen
CID 156713994
Azetidine;methane
CID 160697246
Azetidine;prop-1-ene
CID 168888111

Frequently Asked Questions

What is the IUPAC name of azetidine;ethene?
The IUPAC name of azetidine;ethene (CID 144929598) is azetidine;ethene.
What is the SMILES notation for azetidine;ethene?
The canonical SMILES for azetidine;ethene is C1CNC1.C=C.
What is the InChIKey of azetidine;ethene?
The InChIKey is DDCZVLLNFISFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N.C2H4/c1-2-4-3-1;1-2/h4H,1-3H2;1-2H2.
What are the key properties of azetidine;ethene?
azetidine;ethene has a molecular weight of 85.15 g/mol, XLogP of 0.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azetidine;ethene is sourced from PubChem (CID 144929598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).