5-ethyloct-2-ene

C10H20 — CID 54276882

IUPAC5-ethyloct-2-ene
SMILESCC=CCC(CC)CCC
InChIInChI=1S/C10H20/c1-4-7-9-10(6-3)8-5-2/h4,7,10H,5-6,8-9H2,1-3H3
InChIKeyROADWDVCFBTQQH-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds5

About 5-ethyloct-2-ene

5-ethyloct-2-ene (PubChem CID 54276882) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 5-ethyloct-2-ene.

Molecular Properties

Compound Name5-ethyloct-2-ene
PubChem CID54276882
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name5-ethyloct-2-ene
SMILESCC=CCC(CC)CCC
InChIInChI=1S/C10H20/c1-4-7-9-10(6-3)8-5-2/h4,7,10H,5-6,8-9H2,1-3H3
InChIKeyROADWDVCFBTQQH-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 5-ethyloct-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

Related Compounds

5-butylnon-2-ene
CID 175055679
(Z,2S)-2-ethylhex-4-en-1-ol
CID 89381426
(2Z,4Z)-7-propyldeca-2,4-diene
CID 155725646
3-ethylhexanal
CID 15829179
(E,3R)-N-methoxy-N-methyl-3-propylhept-5-en-1-amine
CID 166735030
5-bromooct-2-ene
CID 57219131
6-ethylnon-2-ene;isocyanic acid
CID 173332593
2-butylhex-4-en-1-amine
CID 91034003
(E)-4,6-diethylnon-1-en-1-amine
CID 163641387
(Z)-4-propyloct-6-en-3-amine
CID 89392102
3-ethyl-N-methylhexan-1-imine
CID 142964967
4-ethylheptane;methane
CID 143165373

Frequently Asked Questions

What is the IUPAC name of 5-ethyloct-2-ene?
The IUPAC name of 5-ethyloct-2-ene (CID 54276882) is 5-ethyloct-2-ene.
What is the SMILES notation for 5-ethyloct-2-ene?
The canonical SMILES for 5-ethyloct-2-ene is CC=CCC(CC)CCC.
What is the InChIKey of 5-ethyloct-2-ene?
The InChIKey is ROADWDVCFBTQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-4-7-9-10(6-3)8-5-2/h4,7,10H,5-6,8-9H2,1-3H3.
What are the key properties of 5-ethyloct-2-ene?
5-ethyloct-2-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyloct-2-ene is sourced from PubChem (CID 54276882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).