5-ethyl-6-methyloct-3-ene

C11H22 — CID 90715471

IUPAC5-ethyl-6-methyloct-3-ene
SMILESCCC=CC(CC)C(C)CC
InChIInChI=1S/C11H22/c1-5-8-9-11(7-3)10(4)6-2/h8-11H,5-7H2,1-4H3
InChIKeyJNCSBTKTIXOSKE-UHFFFAOYSA-N
MW154.30 g/mol
LogP4.02
Rot. Bonds5

About 5-ethyl-6-methyloct-3-ene

5-ethyl-6-methyloct-3-ene (PubChem CID 90715471) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 5-ethyl-6-methyloct-3-ene.

Molecular Properties

Compound Name5-ethyl-6-methyloct-3-ene
PubChem CID90715471
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name5-ethyl-6-methyloct-3-ene
SMILESCCC=CC(CC)C(C)CC
InChIInChI=1S/C11H22/c1-5-8-9-11(7-3)10(4)6-2/h8-11H,5-7H2,1-4H3
InChIKeyJNCSBTKTIXOSKE-UHFFFAOYSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 5-ethyl-6-methyloct-3-ene 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

(Z)-5-methylhept-3-ene
CID 5364727
(E)-5-ethylnon-6-en-4-ol
CID 22754648
8-methyl-5-propan-2-ylnon-3-ene
CID 123416955
5-hept-4-en-3-yloxyhept-3-ene
CID 173176301
(E)-2-bromohex-3-ene
CID 15881334
(E)-1-ethoxy-4-ethyl-5-methylhex-2-ene
CID 177330593
(E)-7,8-dimethyldec-3-ene
CID 164805816
(E)-hex-3-en-2-amine;hydrochloride
CID 55289622
(E,3R)-hept-4-en-3-ol
CID 11007865
(E)-5-bromohept-3-ene
CID 10888461
(E,2R,3S)-2-methyl-3-propylhept-4-enal
CID 118242772
(E)-2-methylhept-4-ene-1,3-diol
CID 14758919

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-methyloct-3-ene?
The IUPAC name of 5-ethyl-6-methyloct-3-ene (CID 90715471) is 5-ethyl-6-methyloct-3-ene.
What is the SMILES notation for 5-ethyl-6-methyloct-3-ene?
The canonical SMILES for 5-ethyl-6-methyloct-3-ene is CCC=CC(CC)C(C)CC.
What is the InChIKey of 5-ethyl-6-methyloct-3-ene?
The InChIKey is JNCSBTKTIXOSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-5-8-9-11(7-3)10(4)6-2/h8-11H,5-7H2,1-4H3.
What are the key properties of 5-ethyl-6-methyloct-3-ene?
5-ethyl-6-methyloct-3-ene has a molecular weight of 154.30 g/mol, XLogP of 4.02, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-methyloct-3-ene is sourced from PubChem (CID 90715471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).