decylcyclohexane

C16H32 — CID 15713

IUPACdecylcyclohexane
SMILESCCCCCCCCCCC1CCCCC1
InChIInChI=1S/C16H32/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h16H,2-15H2,1H3
InChIKeySTWFZICHPLEOIC-UHFFFAOYSA-N
MW224.43 g/mol
LogP6.10
Rot. Bonds9

About decylcyclohexane

decylcyclohexane (PubChem CID 15713) has the molecular formula C16H32 and a molecular weight of 224.43 g/mol. Its IUPAC name is decylcyclohexane.

Molecular Properties

Compound Namedecylcyclohexane
PubChem CID15713
Molecular FormulaC16H32
Molecular Weight224.43 g/mol
Exact Mass224.25
IUPAC Namedecylcyclohexane
SMILESCCCCCCCCCCC1CCCCC1
InChIInChI=1S/C16H32/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h16H,2-15H2,1H3
InChIKeySTWFZICHPLEOIC-UHFFFAOYSA-N
XLogP6.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.43
LogP ≤ 56.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze decylcyclohexane 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

Pristane
CID 15979
Butylcyclohexane
CID 15506
1-Methyl-4-isopropylcyclohexane
CID 7459
Squalane
CID 8089
Isopropylcyclohexane
CID 12763
Ethylcyclohexane
CID 15504
Phytane
CID 12523
Pentylcyclohexane
CID 20284
Farnesane
CID 19773
Propylcyclohexane
CID 15505
sec-Butylcyclohexane
CID 23468
Cyclohexane, 1-methyl-3-(1-methylethyl)-
CID 27938

Frequently Asked Questions

What is the IUPAC name of decylcyclohexane?
The IUPAC name of decylcyclohexane (CID 15713) is decylcyclohexane.
What is the SMILES notation for decylcyclohexane?
The canonical SMILES for decylcyclohexane is CCCCCCCCCCC1CCCCC1.
What is the InChIKey of decylcyclohexane?
The InChIKey is STWFZICHPLEOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h16H,2-15H2,1H3.
What are the key properties of decylcyclohexane?
decylcyclohexane has a molecular weight of 224.43 g/mol, XLogP of 6.10, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for decylcyclohexane is sourced from PubChem (CID 15713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).