3,8,15,20-tetramethylidenedocosane

C26H46 — CID 176610318

IUPAC3,8,15,20-tetramethylidenedocosane
SMILESC=C(CC)CCCCC(=C)CCCCCCC(=C)CCCCC(=C)CC
InChIInChI=1S/C26H46/c1-7-23(3)17-13-15-21-25(5)19-11-9-10-12-20-26(6)22-16-14-18-24(4)8-2/h3-22H2,1-2H3
InChIKeyZHSRWCDQUMHECZ-UHFFFAOYSA-N
MW358.65 g/mol
LogP9.49
Rot. Bonds19

About 3,8,15,20-tetramethylidenedocosane

3,8,15,20-tetramethylidenedocosane (PubChem CID 176610318) has the molecular formula C26H46 and a molecular weight of 358.65 g/mol. Its IUPAC name is 3,8,15,20-tetramethylidenedocosane.

Molecular Properties

Compound Name3,8,15,20-tetramethylidenedocosane
PubChem CID176610318
Molecular FormulaC26H46
Molecular Weight358.65 g/mol
Exact Mass358.36
IUPAC Name3,8,15,20-tetramethylidenedocosane
SMILESC=C(CC)CCCCC(=C)CCCCCCC(=C)CCCCC(=C)CC
InChIInChI=1S/C26H46/c1-7-23(3)17-13-15-21-25(5)19-11-9-10-12-20-26(6)22-16-14-18-24(4)8-2/h3-22H2,1-2H3
InChIKeyZHSRWCDQUMHECZ-UHFFFAOYSA-N
XLogP9.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds19
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.65
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 3,8,15,20-tetramethylidenedocosane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,8-dimethylidenetetradecane
CID 173410299
3-methylidenedecane
CID 21453024
18-methylideneicosanoic acid
CID 154487805
9-methylidenehenicosane;11-methylidenehenicosane;9-methylidenenonadecane;3-methylidenepentadecane;7-methylidenepentadecane;3-methylidenetridecane;5-methylidenetridecane;7-methylidenetridecane;5-methylideneundecane;2-methylpentadec-1-ene;2-methyltridec-1-ene
CID 173451985
6-methylidenetetradecane
CID 21477883
6-methylidenedodecane
CID 21453027
butane;3,8-dimethylideneundecane;pentane;propane
CID 143697639
19-methylideneheptatriacontane;titanium
CID 174477367
3,8-dimethylidenetetradecane;bis(oct-1-ene)
CID 173443691
4-methylidenetricosane
CID 139983205
4-methylidenenonadecane
CID 139983203
trimethyl(5-methylideneheptyl)azanium
CID 123308775

Frequently Asked Questions

What is the IUPAC name of 3,8,15,20-tetramethylidenedocosane?
The IUPAC name of 3,8,15,20-tetramethylidenedocosane (CID 176610318) is 3,8,15,20-tetramethylidenedocosane.
What is the SMILES notation for 3,8,15,20-tetramethylidenedocosane?
The canonical SMILES for 3,8,15,20-tetramethylidenedocosane is C=C(CC)CCCCC(=C)CCCCCCC(=C)CCCCC(=C)CC.
What is the InChIKey of 3,8,15,20-tetramethylidenedocosane?
The InChIKey is ZHSRWCDQUMHECZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H46/c1-7-23(3)17-13-15-21-25(5)19-11-9-10-12-20-26(6)22-16-14-18-24(4)8-2/h3-22H2,1-2H3.
What are the key properties of 3,8,15,20-tetramethylidenedocosane?
3,8,15,20-tetramethylidenedocosane has a molecular weight of 358.65 g/mol, XLogP of 9.49, 19 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8,15,20-tetramethylidenedocosane is sourced from PubChem (CID 176610318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).