3,5-dimethyloct-1-ene

C10H19+ — CID 91430613

IUPAC3,5-dimethyloct-1-ene
SMILESC=C[C+](C)CC(C)CCC
InChIInChI=1S/C10H19/c1-5-7-10(4)8-9(3)6-2/h6,10H,2,5,7-8H2,1,3-4H3/q+1
InChIKeyOQGYHBJZYJFYOJ-UHFFFAOYSA-N
MW139.26 g/mol
LogP3.59
Rot. Bonds5

About 3,5-dimethyloct-1-ene

3,5-dimethyloct-1-ene (PubChem CID 91430613) has the molecular formula C10H19+ and a molecular weight of 139.26 g/mol. Its IUPAC name is 3,5-dimethyloct-1-ene.

Molecular Properties

Compound Name3,5-dimethyloct-1-ene
PubChem CID91430613
Molecular FormulaC10H19+
Molecular Weight139.26 g/mol
Exact Mass139.15
IUPAC Name3,5-dimethyloct-1-ene
SMILESC=C[C+](C)CC(C)CCC
InChIInChI=1S/C10H19/c1-5-7-10(4)8-9(3)6-2/h6,10H,2,5,7-8H2,1,3-4H3/q+1
InChIKeyOQGYHBJZYJFYOJ-UHFFFAOYSA-N
XLogP3.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.26
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyloct-1-ene?
The IUPAC name of 3,5-dimethyloct-1-ene (CID 91430613) is 3,5-dimethyloct-1-ene.
What is the SMILES notation for 3,5-dimethyloct-1-ene?
The canonical SMILES for 3,5-dimethyloct-1-ene is C=C[C+](C)CC(C)CCC.
What is the InChIKey of 3,5-dimethyloct-1-ene?
The InChIKey is OQGYHBJZYJFYOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19/c1-5-7-10(4)8-9(3)6-2/h6,10H,2,5,7-8H2,1,3-4H3/q+1.
What are the key properties of 3,5-dimethyloct-1-ene?
3,5-dimethyloct-1-ene has a molecular weight of 139.26 g/mol, XLogP of 3.59, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyloct-1-ene is sourced from PubChem (CID 91430613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).