1-cyclohexyl-6-propylcyclodecane

C19H36 — CID 58552139

IUPAC1-cyclohexyl-6-propylcyclodecane
SMILESCCCC1CCCCC(C2CCCCC2)CCCC1
InChIInChI=1S/C19H36/c1-2-10-17-11-6-8-15-19(16-9-7-12-17)18-13-4-3-5-14-18/h17-19H,2-16H2,1H3
InChIKeyPFJHBQRJKGJRGS-UHFFFAOYSA-N
MW264.50 g/mol
LogP6.73
Rot. Bonds3

About 1-cyclohexyl-6-propylcyclodecane

1-cyclohexyl-6-propylcyclodecane (PubChem CID 58552139) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is 1-cyclohexyl-6-propylcyclodecane.

Molecular Properties

Compound Name1-cyclohexyl-6-propylcyclodecane
PubChem CID58552139
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name1-cyclohexyl-6-propylcyclodecane
SMILESCCCC1CCCCC(C2CCCCC2)CCCC1
InChIInChI=1S/C19H36/c1-2-10-17-11-6-8-15-19(16-9-7-12-17)18-13-4-3-5-14-18/h17-19H,2-16H2,1H3
InChIKeyPFJHBQRJKGJRGS-UHFFFAOYSA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 56.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-6-propylcyclodecane?
The IUPAC name of 1-cyclohexyl-6-propylcyclodecane (CID 58552139) is 1-cyclohexyl-6-propylcyclodecane.
What is the SMILES notation for 1-cyclohexyl-6-propylcyclodecane?
The canonical SMILES for 1-cyclohexyl-6-propylcyclodecane is CCCC1CCCCC(C2CCCCC2)CCCC1.
What is the InChIKey of 1-cyclohexyl-6-propylcyclodecane?
The InChIKey is PFJHBQRJKGJRGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36/c1-2-10-17-11-6-8-15-19(16-9-7-12-17)18-13-4-3-5-14-18/h17-19H,2-16H2,1H3.
What are the key properties of 1-cyclohexyl-6-propylcyclodecane?
1-cyclohexyl-6-propylcyclodecane has a molecular weight of 264.50 g/mol, XLogP of 6.73, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-6-propylcyclodecane is sourced from PubChem (CID 58552139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).