4-ethyl-3-methylideneoct-4-ene

C11H20 — CID 54376139

IUPAC4-ethyl-3-methylideneoct-4-ene
SMILESC=C(CC)C(=CCCC)CC
InChIInChI=1S/C11H20/c1-5-8-9-11(7-3)10(4)6-2/h9H,4-8H2,1-3H3
InChIKeyUWPOTMOTJOWZBU-UHFFFAOYSA-N
MW152.28 g/mol
LogP4.09
Rot. Bonds5

About 4-ethyl-3-methylideneoct-4-ene

4-ethyl-3-methylideneoct-4-ene (PubChem CID 54376139) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 4-ethyl-3-methylideneoct-4-ene.

Molecular Properties

Compound Name4-ethyl-3-methylideneoct-4-ene
PubChem CID54376139
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name4-ethyl-3-methylideneoct-4-ene
SMILESC=C(CC)C(=CCCC)CC
InChIInChI=1S/C11H20/c1-5-8-9-11(7-3)10(4)6-2/h9H,4-8H2,1-3H3
InChIKeyUWPOTMOTJOWZBU-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 4-ethyl-3-methylideneoct-4-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-prop-1-en-2-ylnon-4-ene
CID 177440529
[(Z)-2-ethylhex-2-enoyl] (Z)-2-ethylhex-2-enoate
CID 87703227
(E)-2-ethylhex-2-enamide
CID 87982228
prop-2-enyl 2-ethylhex-2-enoate
CID 139948290
6-ethyldec-6-ene-2,5-dione
CID 57181280
6-ethyl-4-fluorodeca-3,6-dien-5-one
CID 139816653
(Z)-4-ethyl-2-methyloct-4-en-3-imine
CID 176962442
methyl 2-prop-2-enylhex-2-enoate
CID 174771854
pent-1-ene-1,1-diol
CID 21473005
CID 154668407
CID 154668407
2,8-dimethyldodeca-1,8-diene
CID 91581739
3-ethyl-7-methylocta-3,7-dien-2-one
CID 54536933

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-methylideneoct-4-ene?
The IUPAC name of 4-ethyl-3-methylideneoct-4-ene (CID 54376139) is 4-ethyl-3-methylideneoct-4-ene.
What is the SMILES notation for 4-ethyl-3-methylideneoct-4-ene?
The canonical SMILES for 4-ethyl-3-methylideneoct-4-ene is C=C(CC)C(=CCCC)CC.
What is the InChIKey of 4-ethyl-3-methylideneoct-4-ene?
The InChIKey is UWPOTMOTJOWZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-5-8-9-11(7-3)10(4)6-2/h9H,4-8H2,1-3H3.
What are the key properties of 4-ethyl-3-methylideneoct-4-ene?
4-ethyl-3-methylideneoct-4-ene has a molecular weight of 152.28 g/mol, XLogP of 4.09, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-methylideneoct-4-ene is sourced from PubChem (CID 54376139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).