3-methylidenepent-1-ene;penta-1,3-diene

C11H18 — CID 158839725

IUPAC3-methylidenepent-1-ene;penta-1,3-diene
SMILESC=CC(=C)CC.C=CC=CC
InChIInChI=1S/C6H10.C5H8/c1-4-6(3)5-2;1-3-5-4-2/h4H,1,3,5H2,2H3;3-5H,1H2,2H3
InChIKeyIYBUWERNWTWZAR-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.89
Rot. Bonds3

About 3-methylidenepent-1-ene;penta-1,3-diene

3-methylidenepent-1-ene;penta-1,3-diene (PubChem CID 158839725) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 3-methylidenepent-1-ene;penta-1,3-diene.

Molecular Properties

Compound Name3-methylidenepent-1-ene;penta-1,3-diene
PubChem CID158839725
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name3-methylidenepent-1-ene;penta-1,3-diene
SMILESC=CC(=C)CC.C=CC=CC
InChIInChI=1S/C6H10.C5H8/c1-4-6(3)5-2;1-3-5-4-2/h4H,1,3,5H2,2H3;3-5H,1H2,2H3
InChIKeyIYBUWERNWTWZAR-UHFFFAOYSA-N
XLogP3.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-methylidenepent-1-ene
CID 18850
methane;(3E)-penta-1,3-diene;propane
CID 143129609
ethane;penta-1,3-diene;propane
CID 143367111
(3E)-penta-1,3-diene
CID 71777643
(Z)-but-2-ene;ethane;(3Z)-penta-1,3-diene;propane
CID 142056064
ethane;(3Z)-penta-1,3-diene;propane;prop-1-ene
CID 142061994
hexa-1,3-diene;4-methylidenehex-2-ene
CID 174375907
(3E)-penta-1,3-diene;hydrochloride
CID 87892930
(3E)-penta-1,3-diene;titanium(2+)
CID 22149558
2-methylbut-2-ene;(3E)-penta-1,3-diene
CID 6441481
3-iodohex-3-ene;penta-1,3-diene
CID 173447281
ethane;methane;(2Z,4Z)-6-methylideneocta-2,4-diene
CID 143380166

Frequently Asked Questions

What is the IUPAC name of 3-methylidenepent-1-ene;penta-1,3-diene?
The IUPAC name of 3-methylidenepent-1-ene;penta-1,3-diene (CID 158839725) is 3-methylidenepent-1-ene;penta-1,3-diene.
What is the SMILES notation for 3-methylidenepent-1-ene;penta-1,3-diene?
The canonical SMILES for 3-methylidenepent-1-ene;penta-1,3-diene is C=CC(=C)CC.C=CC=CC.
What is the InChIKey of 3-methylidenepent-1-ene;penta-1,3-diene?
The InChIKey is IYBUWERNWTWZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10.C5H8/c1-4-6(3)5-2;1-3-5-4-2/h4H,1,3,5H2,2H3;3-5H,1H2,2H3.
What are the key properties of 3-methylidenepent-1-ene;penta-1,3-diene?
3-methylidenepent-1-ene;penta-1,3-diene has a molecular weight of 150.26 g/mol, XLogP of 3.89, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidenepent-1-ene;penta-1,3-diene is sourced from PubChem (CID 158839725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).