1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane

C19H38 — CID 167644574

IUPAC1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane
SMILESCC(C)C1(C(C)C)CCCC1.CC(C)C1CCCC1
InChIInChI=1S/C11H22.C8H16/c1-9(2)11(10(3)4)7-5-6-8-11;1-7(2)8-5-3-4-6-8/h9-10H,5-8H2,1-4H3;7-8H,3-6H2,1-2H3
InChIKeyPRBAYLTUBFPGRU-UHFFFAOYSA-N
MW266.51 g/mol
LogP6.69
Rot. Bonds3

About 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane

1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane (PubChem CID 167644574) has the molecular formula C19H38 and a molecular weight of 266.51 g/mol. Its IUPAC name is 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane.

Molecular Properties

Compound Name1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane
PubChem CID167644574
Molecular FormulaC19H38
Molecular Weight266.51 g/mol
Exact Mass266.30
IUPAC Name1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane
SMILESCC(C)C1(C(C)C)CCCC1.CC(C)C1CCCC1
InChIInChI=1S/C11H22.C8H16/c1-9(2)11(10(3)4)7-5-6-8-11;1-7(2)8-5-3-4-6-8/h9-10H,5-8H2,1-4H3;7-8H,3-6H2,1-2H3
InChIKeyPRBAYLTUBFPGRU-UHFFFAOYSA-N
XLogP6.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.51
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane 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

1,1-bis(1-cyclohexylethyl)cyclohexane
CID 23163026
1,1-di(propan-2-yl)cycloheptane
CID 23589303
1,1-di(propan-2-yl)cyclobutane;propan-2-ylcyclobutane;3-propan-2-yloxolane
CID 163492322
1,1-dimethyl-4-propan-2-ylcyclohexane;propan-2-ylcyclohexane
CID 165006340
carbanide;iron(2+);bis(propan-2-ylcyclopentane)
CID 162282173
methane;propan-2-ylcyclotetradecane
CID 159882779
propane;propan-2-ylcyclopentane
CID 91615250
ethane;methane;propan-2-ylcyclohexane
CID 169430642
1-(1-methylcyclopentyl)ethylcyclohexane
CID 91321449
2,2-dimethylpropane;propan-2-ylcyclohexane
CID 159663996
benzene;propan-2-ylcyclohexane
CID 163364158
1,4-di(propan-2-yl)cycloheptan-1-amine
CID 65086898

Frequently Asked Questions

What is the IUPAC name of 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane?
The IUPAC name of 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane (CID 167644574) is 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane.
What is the SMILES notation for 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane?
The canonical SMILES for 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane is CC(C)C1(C(C)C)CCCC1.CC(C)C1CCCC1.
What is the InChIKey of 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane?
The InChIKey is PRBAYLTUBFPGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22.C8H16/c1-9(2)11(10(3)4)7-5-6-8-11;1-7(2)8-5-3-4-6-8/h9-10H,5-8H2,1-4H3;7-8H,3-6H2,1-2H3.
What are the key properties of 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane?
1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane has a molecular weight of 266.51 g/mol, XLogP of 6.69, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane is sourced from PubChem (CID 167644574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).