5-butyl-7,8-dimethylnon-1-ene

C15H30 — CID 123319665

IUPAC5-butyl-7,8-dimethylnon-1-ene
SMILESC=CCCC(CCCC)CC(C)C(C)C
InChIInChI=1S/C15H30/c1-6-8-10-15(11-9-7-2)12-14(5)13(3)4/h6,13-15H,1,7-12H2,2-5H3
InChIKeyZHEVLBJARJGFBQ-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.44
Rot. Bonds9

About 5-butyl-7,8-dimethylnon-1-ene

5-butyl-7,8-dimethylnon-1-ene (PubChem CID 123319665) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 5-butyl-7,8-dimethylnon-1-ene.

Molecular Properties

Compound Name5-butyl-7,8-dimethylnon-1-ene
PubChem CID123319665
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name5-butyl-7,8-dimethylnon-1-ene
SMILESC=CCCC(CCCC)CC(C)C(C)C
InChIInChI=1S/C15H30/c1-6-8-10-15(11-9-7-2)12-14(5)13(3)4/h6,13-15H,1,7-12H2,2-5H3
InChIKeyZHEVLBJARJGFBQ-UHFFFAOYSA-N
XLogP5.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 5-butyl-7,8-dimethylnon-1-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

5-butyl-2,3-dimethylnonane
CID 123894711
9-(2,3-dimethylbutyl)octadecane
CID 123942362
5-methyl-6-propan-2-yldec-1-ene
CID 90885410
7-butylundec-1-ene
CID 174048295
6-propyldec-1-ene
CID 22251175
7-propylundec-1-ene
CID 174048285
9-butyltetracosane;icosane;oct-1-ene
CID 159857155
6,7,8,9-tetramethyltetradec-1-ene
CID 57142635
26-heptadecylnonapentacont-1-ene
CID 123445046
7-methylundec-1-ene
CID 522554
7-pentyltridec-1-ene
CID 123620244
12-pentyltricosa-1,22-diene
CID 102409743

Frequently Asked Questions

What is the IUPAC name of 5-butyl-7,8-dimethylnon-1-ene?
The IUPAC name of 5-butyl-7,8-dimethylnon-1-ene (CID 123319665) is 5-butyl-7,8-dimethylnon-1-ene.
What is the SMILES notation for 5-butyl-7,8-dimethylnon-1-ene?
The canonical SMILES for 5-butyl-7,8-dimethylnon-1-ene is C=CCCC(CCCC)CC(C)C(C)C.
What is the InChIKey of 5-butyl-7,8-dimethylnon-1-ene?
The InChIKey is ZHEVLBJARJGFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-6-8-10-15(11-9-7-2)12-14(5)13(3)4/h6,13-15H,1,7-12H2,2-5H3.
What are the key properties of 5-butyl-7,8-dimethylnon-1-ene?
5-butyl-7,8-dimethylnon-1-ene has a molecular weight of 210.40 g/mol, XLogP of 5.44, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-7,8-dimethylnon-1-ene is sourced from PubChem (CID 123319665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).