2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine

C15H27N — CID 134257788

IUPAC2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine
SMILES[H]/N=C/CC1CCCC/C=C\CCCCCC1
InChIInChI=1S/C15H27N/c16-14-13-15-11-9-7-5-3-1-2-4-6-8-10-12-15/h1,3,14-16H,2,4-13H2/b3-1-,16-14+
InChIKeyJSYLYSTUIDFIAQ-ZHUICSNQSA-N
MW221.39 g/mol
LogP5.11
Rot. Bonds2

About 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine

2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine (PubChem CID 134257788) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine.

Molecular Properties

Compound Name2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine
PubChem CID134257788
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine
SMILES[H]/N=C/CC1CCCC/C=C\CCCCCC1
InChIInChI=1S/C15H27N/c16-14-13-15-11-9-7-5-3-1-2-4-6-8-10-12-15/h1,3,14-16H,2,4-13H2/b3-1-,16-14+
InChIKeyJSYLYSTUIDFIAQ-ZHUICSNQSA-N
XLogP5.11
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500221.39
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine 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-[(6Z)-cyclotridec-6-en-1-yl]ethanimine?
The IUPAC name of 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine (CID 134257788) is 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine.
What is the SMILES notation for 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine?
The canonical SMILES for 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine is [H]/N=C/CC1CCCC/C=C\CCCCCC1.
What is the InChIKey of 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine?
The InChIKey is JSYLYSTUIDFIAQ-ZHUICSNQSA-N. The full InChI is InChI=1S/C15H27N/c16-14-13-15-11-9-7-5-3-1-2-4-6-8-10-12-15/h1,3,14-16H,2,4-13H2/b3-1-,16-14+.
What are the key properties of 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine?
2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine has a molecular weight of 221.39 g/mol, XLogP of 5.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6Z)-cyclotridec-6-en-1-yl]ethanimine is sourced from PubChem (CID 134257788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).