2-(cyclododecylideneamino)guanidine

C13H26N4 — CID 2817436

IUPAC2-(cyclododecylideneamino)guanidine
SMILESNC(N)=NN=C1CCCCCCCCCCC1
InChIInChI=1S/C13H26N4/c14-13(15)17-16-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2,(H4,14,15,17)
InChIKeyUQYQSGCOBNYDBF-UHFFFAOYSA-N
MW238.38 g/mol
LogP2.92
Rot. Bonds1

About 2-(cyclododecylideneamino)guanidine

2-(cyclododecylideneamino)guanidine (PubChem CID 2817436) has the molecular formula C13H26N4 and a molecular weight of 238.38 g/mol. Its IUPAC name is 2-(cyclododecylideneamino)guanidine.

Molecular Properties

Compound Name2-(cyclododecylideneamino)guanidine
PubChem CID2817436
Molecular FormulaC13H26N4
Molecular Weight238.38 g/mol
Exact Mass238.22
IUPAC Name2-(cyclododecylideneamino)guanidine
SMILESNC(N)=NN=C1CCCCCCCCCCC1
InChIInChI=1S/C13H26N4/c14-13(15)17-16-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2,(H4,14,15,17)
InChIKeyUQYQSGCOBNYDBF-UHFFFAOYSA-N
XLogP2.92
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(cyclododecylideneamino)guanidine 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 2-(cyclododecylideneamino)guanidine?
The IUPAC name of 2-(cyclododecylideneamino)guanidine (CID 2817436) is 2-(cyclododecylideneamino)guanidine.
What is the SMILES notation for 2-(cyclododecylideneamino)guanidine?
The canonical SMILES for 2-(cyclododecylideneamino)guanidine is NC(N)=NN=C1CCCCCCCCCCC1.
What is the InChIKey of 2-(cyclododecylideneamino)guanidine?
The InChIKey is UQYQSGCOBNYDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4/c14-13(15)17-16-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2,(H4,14,15,17).
What are the key properties of 2-(cyclododecylideneamino)guanidine?
2-(cyclododecylideneamino)guanidine has a molecular weight of 238.38 g/mol, XLogP of 2.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclododecylideneamino)guanidine is sourced from PubChem (CID 2817436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).