2,6,10,14-tetramethylhexadec-2-ene

C20H40 — CID 521742

IUPAC2,6,10,14-tetramethylhexadec-2-ene
SMILESCCC(C)CCCC(C)CCCC(C)CCC=C(C)C
InChIInChI=1S/C20H40/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h11,18-20H,7-10,12-16H2,1-6H3
InChIKeyVUODLTHTSSVQSK-UHFFFAOYSA-N
MW280.54 g/mol
LogP7.39
Rot. Bonds12

About 2,6,10,14-tetramethylhexadec-2-ene

2,6,10,14-tetramethylhexadec-2-ene (PubChem CID 521742) has the molecular formula C20H40 and a molecular weight of 280.54 g/mol. Its IUPAC name is 2,6,10,14-tetramethylhexadec-2-ene.

Molecular Properties

Compound Name2,6,10,14-tetramethylhexadec-2-ene
PubChem CID521742
Molecular FormulaC20H40
Molecular Weight280.54 g/mol
Exact Mass280.31
IUPAC Name2,6,10,14-tetramethylhexadec-2-ene
SMILESCCC(C)CCCC(C)CCCC(C)CCC=C(C)C
InChIInChI=1S/C20H40/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h11,18-20H,7-10,12-16H2,1-6H3
InChIKeyVUODLTHTSSVQSK-UHFFFAOYSA-N
XLogP7.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.54
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2,6,10,14-tetramethylhexadec-2-ene 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 2,6,10,14-tetramethylhexadec-2-ene?
The IUPAC name of 2,6,10,14-tetramethylhexadec-2-ene (CID 521742) is 2,6,10,14-tetramethylhexadec-2-ene.
What is the SMILES notation for 2,6,10,14-tetramethylhexadec-2-ene?
The canonical SMILES for 2,6,10,14-tetramethylhexadec-2-ene is CCC(C)CCCC(C)CCCC(C)CCC=C(C)C.
What is the InChIKey of 2,6,10,14-tetramethylhexadec-2-ene?
The InChIKey is VUODLTHTSSVQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h11,18-20H,7-10,12-16H2,1-6H3.
What are the key properties of 2,6,10,14-tetramethylhexadec-2-ene?
2,6,10,14-tetramethylhexadec-2-ene has a molecular weight of 280.54 g/mol, XLogP of 7.39, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10,14-tetramethylhexadec-2-ene is sourced from PubChem (CID 521742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).