8-methylnon-3-ene

C10H20 — CID 54424784

IUPAC8-methylnon-3-ene
SMILESCCC=CCCCC(C)C
InChIInChI=1S/C10H20/c1-4-5-6-7-8-9-10(2)3/h5-6,10H,4,7-9H2,1-3H3
InChIKeyMWTCCUBOEJQUIB-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds5

About 8-methylnon-3-ene

8-methylnon-3-ene (PubChem CID 54424784) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 8-methylnon-3-ene.

Molecular Properties

Compound Name8-methylnon-3-ene
PubChem CID54424784
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name8-methylnon-3-ene
SMILESCCC=CCCCC(C)C
InChIInChI=1S/C10H20/c1-4-5-6-7-8-9-10(2)3/h5-6,10H,4,7-9H2,1-3H3
InChIKeyMWTCCUBOEJQUIB-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 8-methylnon-3-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-methylnon-3-ene?
The IUPAC name of 8-methylnon-3-ene (CID 54424784) is 8-methylnon-3-ene.
What is the SMILES notation for 8-methylnon-3-ene?
The canonical SMILES for 8-methylnon-3-ene is CCC=CCCCC(C)C.
What is the InChIKey of 8-methylnon-3-ene?
The InChIKey is MWTCCUBOEJQUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-4-5-6-7-8-9-10(2)3/h5-6,10H,4,7-9H2,1-3H3.
What are the key properties of 8-methylnon-3-ene?
8-methylnon-3-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 8-methylnon-3-ene is sourced from PubChem (CID 54424784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).