cyclonona-1,3-diene-1-carboximidamide

C10H16N2 — CID 123709241

IUPACcyclonona-1,3-diene-1-carboximidamide
SMILES[H]/N=C(\N)C1=CC=CCCCCC1
InChIInChI=1S/C10H16N2/c11-10(12)9-7-5-3-1-2-4-6-8-9/h3,5,7H,1-2,4,6,8H2,(H3,11,12)
InChIKeyYCMHDISOSMUBBW-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.37
Rot. Bonds1

About cyclonona-1,3-diene-1-carboximidamide

cyclonona-1,3-diene-1-carboximidamide (PubChem CID 123709241) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is cyclonona-1,3-diene-1-carboximidamide.

Molecular Properties

Compound Namecyclonona-1,3-diene-1-carboximidamide
PubChem CID123709241
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Namecyclonona-1,3-diene-1-carboximidamide
SMILES[H]/N=C(\N)C1=CC=CCCCCC1
InChIInChI=1S/C10H16N2/c11-10(12)9-7-5-3-1-2-4-6-8-9/h3,5,7H,1-2,4,6,8H2,(H3,11,12)
InChIKeyYCMHDISOSMUBBW-UHFFFAOYSA-N
XLogP2.37
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze cyclonona-1,3-diene-1-carboximidamide 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 cyclonona-1,3-diene-1-carboximidamide?
The IUPAC name of cyclonona-1,3-diene-1-carboximidamide (CID 123709241) is cyclonona-1,3-diene-1-carboximidamide.
What is the SMILES notation for cyclonona-1,3-diene-1-carboximidamide?
The canonical SMILES for cyclonona-1,3-diene-1-carboximidamide is [H]/N=C(\N)C1=CC=CCCCCC1.
What is the InChIKey of cyclonona-1,3-diene-1-carboximidamide?
The InChIKey is YCMHDISOSMUBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c11-10(12)9-7-5-3-1-2-4-6-8-9/h3,5,7H,1-2,4,6,8H2,(H3,11,12).
What are the key properties of cyclonona-1,3-diene-1-carboximidamide?
cyclonona-1,3-diene-1-carboximidamide has a molecular weight of 164.25 g/mol, XLogP of 2.37, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclonona-1,3-diene-1-carboximidamide is sourced from PubChem (CID 123709241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).