2-non-8-en-2-yloxyethanamine

C11H23NO — CID 155148365

IUPAC2-non-8-en-2-yloxyethanamine
SMILESC=CCCCCCC(C)OCCN
InChIInChI=1S/C11H23NO/c1-3-4-5-6-7-8-11(2)13-10-9-12/h3,11H,1,4-10,12H2,2H3
InChIKeyHWSZIBCCPBVFNS-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.49
Rot. Bonds9

About 2-non-8-en-2-yloxyethanamine

2-non-8-en-2-yloxyethanamine (PubChem CID 155148365) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-non-8-en-2-yloxyethanamine.

Molecular Properties

Compound Name2-non-8-en-2-yloxyethanamine
PubChem CID155148365
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-non-8-en-2-yloxyethanamine
SMILESC=CCCCCCC(C)OCCN
InChIInChI=1S/C11H23NO/c1-3-4-5-6-7-8-11(2)13-10-9-12/h3,11H,1,4-10,12H2,2H3
InChIKeyHWSZIBCCPBVFNS-UHFFFAOYSA-N
XLogP2.49
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-non-8-en-2-yloxyethanamine 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-non-8-en-2-yloxyethanamine?
The IUPAC name of 2-non-8-en-2-yloxyethanamine (CID 155148365) is 2-non-8-en-2-yloxyethanamine.
What is the SMILES notation for 2-non-8-en-2-yloxyethanamine?
The canonical SMILES for 2-non-8-en-2-yloxyethanamine is C=CCCCCCC(C)OCCN.
What is the InChIKey of 2-non-8-en-2-yloxyethanamine?
The InChIKey is HWSZIBCCPBVFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-4-5-6-7-8-11(2)13-10-9-12/h3,11H,1,4-10,12H2,2H3.
What are the key properties of 2-non-8-en-2-yloxyethanamine?
2-non-8-en-2-yloxyethanamine has a molecular weight of 185.31 g/mol, XLogP of 2.49, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-non-8-en-2-yloxyethanamine is sourced from PubChem (CID 155148365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).