(6Z)-1-azoniacycloundec-6-ene chloride

C10H20ClN — CID 11159796

IUPAC(6Z)-1-azoniacycloundec-6-ene chloride
SMILESC1=C\CCCC[NH2+]CCCC/1.[Cl-]
InChIInChI=1S/C10H19N.ClH/c1-2-4-6-8-10-11-9-7-5-3-1;/h1-2,11H,3-10H2;1H/b2-1-;
InChIKeyCOEUGQVHQDFZIW-ODZAUARKSA-N
MW189.73 g/mol
LogP-1.54
Rot. Bonds

About (6Z)-1-azoniacycloundec-6-ene chloride

(6Z)-1-azoniacycloundec-6-ene chloride (PubChem CID 11159796) has the molecular formula C10H20ClN and a molecular weight of 189.73 g/mol. Its IUPAC name is (6Z)-1-azoniacycloundec-6-ene chloride.

Molecular Properties

Compound Name(6Z)-1-azoniacycloundec-6-ene chloride
PubChem CID11159796
Molecular FormulaC10H20ClN
Molecular Weight189.73 g/mol
Exact Mass189.13
IUPAC Name(6Z)-1-azoniacycloundec-6-ene chloride
SMILESC1=C\CCCC[NH2+]CCCC/1.[Cl-]
InChIInChI=1S/C10H19N.ClH/c1-2-4-6-8-10-11-9-7-5-3-1;/h1-2,11H,3-10H2;1H/b2-1-;
InChIKeyCOEUGQVHQDFZIW-ODZAUARKSA-N
XLogP-1.54
TPSA16.61 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.73
LogP ≤ 5-1.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (6Z)-1-azoniacycloundec-6-ene chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6Z)-1-azoniacycloundec-6-ene chloride?
The IUPAC name of (6Z)-1-azoniacycloundec-6-ene chloride (CID 11159796) is (6Z)-1-azoniacycloundec-6-ene chloride.
What is the SMILES notation for (6Z)-1-azoniacycloundec-6-ene chloride?
The canonical SMILES for (6Z)-1-azoniacycloundec-6-ene chloride is C1=C\CCCC[NH2+]CCCC/1.[Cl-].
What is the InChIKey of (6Z)-1-azoniacycloundec-6-ene chloride?
The InChIKey is COEUGQVHQDFZIW-ODZAUARKSA-N. The full InChI is InChI=1S/C10H19N.ClH/c1-2-4-6-8-10-11-9-7-5-3-1;/h1-2,11H,3-10H2;1H/b2-1-;.
What are the key properties of (6Z)-1-azoniacycloundec-6-ene chloride?
(6Z)-1-azoniacycloundec-6-ene chloride has a molecular weight of 189.73 g/mol, XLogP of -1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-1-azoniacycloundec-6-ene chloride is sourced from PubChem (CID 11159796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).