1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine

C10H15N — CID 142366577

IUPAC1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine
SMILESC=C/C=C(\C=C)CN1CCC1
InChIInChI=1S/C10H15N/c1-3-6-10(4-2)9-11-7-5-8-11/h3-4,6H,1-2,5,7-9H2/b10-6+
InChIKeyZMFKXCXOFAYTKB-UXBLZVDNSA-N
MW149.24 g/mol
LogP1.99
Rot. Bonds4

About 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine

1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine (PubChem CID 142366577) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine.

Molecular Properties

Compound Name1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine
PubChem CID142366577
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine
SMILESC=C/C=C(\C=C)CN1CCC1
InChIInChI=1S/C10H15N/c1-3-6-10(4-2)9-11-7-5-8-11/h3-4,6H,1-2,5,7-9H2/b10-6+
InChIKeyZMFKXCXOFAYTKB-UXBLZVDNSA-N
XLogP1.99
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine?
The IUPAC name of 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine (CID 142366577) is 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine.
What is the SMILES notation for 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine?
The canonical SMILES for 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine is C=C/C=C(\C=C)CN1CCC1.
What is the InChIKey of 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine?
The InChIKey is ZMFKXCXOFAYTKB-UXBLZVDNSA-N. The full InChI is InChI=1S/C10H15N/c1-3-6-10(4-2)9-11-7-5-8-11/h3-4,6H,1-2,5,7-9H2/b10-6+.
What are the key properties of 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine?
1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine has a molecular weight of 149.24 g/mol, XLogP of 1.99, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2E)-2-ethenylpenta-2,4-dienyl]azetidine is sourced from PubChem (CID 142366577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).