1-cyclodecyl-5-methylcyclodecane

C21H40 — CID 123747337

IUPAC1-cyclodecyl-5-methylcyclodecane
SMILESCC1CCCCCC(C2CCCCCCCCC2)CCC1
InChIInChI=1S/C21H40/c1-19-13-8-7-11-17-21(18-12-14-19)20-15-9-5-3-2-4-6-10-16-20/h19-21H,2-18H2,1H3
InChIKeyXJYHINHEDXDBPW-UHFFFAOYSA-N
MW292.55 g/mol
LogP7.51
Rot. Bonds1

About 1-cyclodecyl-5-methylcyclodecane

1-cyclodecyl-5-methylcyclodecane (PubChem CID 123747337) has the molecular formula C21H40 and a molecular weight of 292.55 g/mol. Its IUPAC name is 1-cyclodecyl-5-methylcyclodecane.

Molecular Properties

Compound Name1-cyclodecyl-5-methylcyclodecane
PubChem CID123747337
Molecular FormulaC21H40
Molecular Weight292.55 g/mol
Exact Mass292.31
IUPAC Name1-cyclodecyl-5-methylcyclodecane
SMILESCC1CCCCCC(C2CCCCCCCCC2)CCC1
InChIInChI=1S/C21H40/c1-19-13-8-7-11-17-21(18-12-14-19)20-15-9-5-3-2-4-6-10-16-20/h19-21H,2-18H2,1H3
InChIKeyXJYHINHEDXDBPW-UHFFFAOYSA-N
XLogP7.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.55
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-cyclodecyl-5-methylcyclodecane 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-methylbicyclo[11.3.0]hexadecane
CID 58552761
1-cyclooctyl-5-methylcyclooctane;ethane
CID 157211813
1-cyclopentyl-5-methylcyclooctane;ethane;bis(methylcyclooctane)
CID 159863371
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;methylcyclohexane
CID 158943908
1-cyclodecyl-6-methylcycloundecane
CID 123480440
1-(3-cyclooctylcyclopentyl)-5-methylcyclooctane
CID 162472459
methane;methylcyclobutane;methylcyclohexane;methylcyclopentane
CID 159112389
1,6-dimethylcycloundecane
CID 91298161
methylcyclobutane;tetrakis(methylcyclopentane)
CID 160836928
cyclohexane;methylcyclopentane
CID 20788572
6-methyl-1,3-bis(4-methylcyclooctyl)cyclooctane;methylcyclooctane
CID 162228402
1,4-dimethylcycloheptane;1,4-dimethylcyclohexane;methane;methylcyclohexane
CID 161210516

Frequently Asked Questions

What is the IUPAC name of 1-cyclodecyl-5-methylcyclodecane?
The IUPAC name of 1-cyclodecyl-5-methylcyclodecane (CID 123747337) is 1-cyclodecyl-5-methylcyclodecane.
What is the SMILES notation for 1-cyclodecyl-5-methylcyclodecane?
The canonical SMILES for 1-cyclodecyl-5-methylcyclodecane is CC1CCCCCC(C2CCCCCCCCC2)CCC1.
What is the InChIKey of 1-cyclodecyl-5-methylcyclodecane?
The InChIKey is XJYHINHEDXDBPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H40/c1-19-13-8-7-11-17-21(18-12-14-19)20-15-9-5-3-2-4-6-10-16-20/h19-21H,2-18H2,1H3.
What are the key properties of 1-cyclodecyl-5-methylcyclodecane?
1-cyclodecyl-5-methylcyclodecane has a molecular weight of 292.55 g/mol, XLogP of 7.51, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclodecyl-5-methylcyclodecane is sourced from PubChem (CID 123747337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).