11-azidoundec-1-ene

C11H21N3 — CID 10965429

IUPAC11-azidoundec-1-ene
SMILESC=CCCCCCCCCCN=[N+]=[N-]
InChIInChI=1S/C11H21N3/c1-2-3-4-5-6-7-8-9-10-11-13-14-12/h2H,1,3-11H2
InChIKeyQRJPSFQONYKDAW-UHFFFAOYSA-N
MW195.31 g/mol
LogP4.60
Rot. Bonds10

About 11-azidoundec-1-ene

11-azidoundec-1-ene (PubChem CID 10965429) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 11-azidoundec-1-ene.

Molecular Properties

Compound Name11-azidoundec-1-ene
PubChem CID10965429
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name11-azidoundec-1-ene
SMILESC=CCCCCCCCCCN=[N+]=[N-]
InChIInChI=1S/C11H21N3/c1-2-3-4-5-6-7-8-9-10-11-13-14-12/h2H,1,3-11H2
InChIKeyQRJPSFQONYKDAW-UHFFFAOYSA-N
XLogP4.60
TPSA48.76 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 11-azidoundec-1-ene?
The IUPAC name of 11-azidoundec-1-ene (CID 10965429) is 11-azidoundec-1-ene.
What is the SMILES notation for 11-azidoundec-1-ene?
The canonical SMILES for 11-azidoundec-1-ene is C=CCCCCCCCCCN=[N+]=[N-].
What is the InChIKey of 11-azidoundec-1-ene?
The InChIKey is QRJPSFQONYKDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-2-3-4-5-6-7-8-9-10-11-13-14-12/h2H,1,3-11H2.
What are the key properties of 11-azidoundec-1-ene?
11-azidoundec-1-ene has a molecular weight of 195.31 g/mol, XLogP of 4.60, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11-azidoundec-1-ene is sourced from PubChem (CID 10965429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).