5-methylidene-1-propylcyclodecene

C14H24 — CID 123607448

IUPAC5-methylidene-1-propylcyclodecene
SMILESC=C1CCC=C(CCC)CCCCC1
InChIInChI=1S/C14H24/c1-3-8-14-11-6-4-5-9-13(2)10-7-12-14/h12H,2-11H2,1H3
InChIKeyYVOKZAYMAANJPO-UHFFFAOYSA-N
MW192.35 g/mol
LogP5.01
Rot. Bonds2

About 5-methylidene-1-propylcyclodecene

5-methylidene-1-propylcyclodecene (PubChem CID 123607448) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 5-methylidene-1-propylcyclodecene.

Molecular Properties

Compound Name5-methylidene-1-propylcyclodecene
PubChem CID123607448
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name5-methylidene-1-propylcyclodecene
SMILESC=C1CCC=C(CCC)CCCCC1
InChIInChI=1S/C14H24/c1-3-8-14-11-6-4-5-9-13(2)10-7-12-14/h12H,2-11H2,1H3
InChIKeyYVOKZAYMAANJPO-UHFFFAOYSA-N
XLogP5.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500192.35
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methylidene-1-propylcyclodecene?
The IUPAC name of 5-methylidene-1-propylcyclodecene (CID 123607448) is 5-methylidene-1-propylcyclodecene.
What is the SMILES notation for 5-methylidene-1-propylcyclodecene?
The canonical SMILES for 5-methylidene-1-propylcyclodecene is C=C1CCC=C(CCC)CCCCC1.
What is the InChIKey of 5-methylidene-1-propylcyclodecene?
The InChIKey is YVOKZAYMAANJPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-3-8-14-11-6-4-5-9-13(2)10-7-12-14/h12H,2-11H2,1H3.
What are the key properties of 5-methylidene-1-propylcyclodecene?
5-methylidene-1-propylcyclodecene has a molecular weight of 192.35 g/mol, XLogP of 5.01, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-1-propylcyclodecene is sourced from PubChem (CID 123607448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).