(1E)-3-methylcyclodecene

C11H20 — CID 5352563

IUPAC(1E)-3-methylcyclodecene
SMILESCC1/C=C/CCCCCCC1
InChIInChI=1S/C11H20/c1-11-9-7-5-3-2-4-6-8-10-11/h7,9,11H,2-6,8,10H2,1H3/b9-7+
InChIKeyKBSFLXNAAXKOMU-VQHVLOKHSA-N
MW152.28 g/mol
LogP3.92
Rot. Bonds

About (1E)-3-methylcyclodecene

(1E)-3-methylcyclodecene (PubChem CID 5352563) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is (1E)-3-methylcyclodecene.

Molecular Properties

Compound Name(1E)-3-methylcyclodecene
PubChem CID5352563
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name(1E)-3-methylcyclodecene
SMILESCC1/C=C/CCCCCCC1
InChIInChI=1S/C11H20/c1-11-9-7-5-3-2-4-6-8-10-11/h7,9,11H,2-6,8,10H2,1H3/b9-7+
InChIKeyKBSFLXNAAXKOMU-VQHVLOKHSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.92
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 (1E)-3-methylcyclodecene?
The IUPAC name of (1E)-3-methylcyclodecene (CID 5352563) is (1E)-3-methylcyclodecene.
What is the SMILES notation for (1E)-3-methylcyclodecene?
The canonical SMILES for (1E)-3-methylcyclodecene is CC1/C=C/CCCCCCC1.
What is the InChIKey of (1E)-3-methylcyclodecene?
The InChIKey is KBSFLXNAAXKOMU-VQHVLOKHSA-N. The full InChI is InChI=1S/C11H20/c1-11-9-7-5-3-2-4-6-8-10-11/h7,9,11H,2-6,8,10H2,1H3/b9-7+.
What are the key properties of (1E)-3-methylcyclodecene?
(1E)-3-methylcyclodecene has a molecular weight of 152.28 g/mol, XLogP of 3.92, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-3-methylcyclodecene is sourced from PubChem (CID 5352563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).