cyclopentane;2,2-dimethylbutylcyclopentane;propane

C25H56 — CID 162289353

IUPACcyclopentane;2,2-dimethylbutylcyclopentane;propane
SMILESC1CCCC1.CCC.CCC.CCC.CCC(C)(C)CC1CCCC1
InChIInChI=1S/C11H22.C5H10.3C3H8/c1-4-11(2,3)9-10-7-5-6-8-10;1-2-4-5-3-1;3*1-3-2/h10H,4-9H2,1-3H3;1-5H2;3*3H2,1-2H3
InChIKeyIWCIIBFKNMNCHB-UHFFFAOYSA-N
MW356.72 g/mol
LogP10.20
Rot. Bonds3

About cyclopentane;2,2-dimethylbutylcyclopentane;propane

cyclopentane;2,2-dimethylbutylcyclopentane;propane (PubChem CID 162289353) has the molecular formula C25H56 and a molecular weight of 356.72 g/mol. Its IUPAC name is cyclopentane;2,2-dimethylbutylcyclopentane;propane.

Molecular Properties

Compound Namecyclopentane;2,2-dimethylbutylcyclopentane;propane
PubChem CID162289353
Molecular FormulaC25H56
Molecular Weight356.72 g/mol
Exact Mass356.44
IUPAC Namecyclopentane;2,2-dimethylbutylcyclopentane;propane
SMILESC1CCCC1.CCC.CCC.CCC.CCC(C)(C)CC1CCCC1
InChIInChI=1S/C11H22.C5H10.3C3H8/c1-4-11(2,3)9-10-7-5-6-8-10;1-2-4-5-3-1;3*1-3-2/h10H,4-9H2,1-3H3;1-5H2;3*3H2,1-2H3
InChIKeyIWCIIBFKNMNCHB-UHFFFAOYSA-N
XLogP10.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.72
LogP ≤ 510.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze cyclopentane;2,2-dimethylbutylcyclopentane;propane 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

3-cyclopentyl-2,2-dimethylpropan-1-amine;hydrochloride
CID 122240185
1-(2,2-dimethylbutyl)-3-ethylcyclopentane
CID 91360585
2-(2,2-dimethylbutyl)-oxacyclononadecane
CID 173129574
1-cyclohexyl-2-methylpropan-2-ol;ethane
CID 91251798
1-cyclopentyl-2-methylpropan-2-ol
CID 18424051
N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine
CID 62723939
2-amino-1-cyclohexylpropan-2-ol
CID 57094409
2-(cyclopentylmethyl)-2-methylbutanoic acid
CID 62740428
propylcyclotetradecane
CID 90991550
N-(cyclopentylmethyl)-N,2,2-trimethylbutan-1-amine
CID 138459636
2,2-dimethylpropane;2,2-dimethylpropylcyclobutane
CID 167591215
CID 22399719
CID 22399719

Frequently Asked Questions

What is the IUPAC name of cyclopentane;2,2-dimethylbutylcyclopentane;propane?
The IUPAC name of cyclopentane;2,2-dimethylbutylcyclopentane;propane (CID 162289353) is cyclopentane;2,2-dimethylbutylcyclopentane;propane.
What is the SMILES notation for cyclopentane;2,2-dimethylbutylcyclopentane;propane?
The canonical SMILES for cyclopentane;2,2-dimethylbutylcyclopentane;propane is C1CCCC1.CCC.CCC.CCC.CCC(C)(C)CC1CCCC1.
What is the InChIKey of cyclopentane;2,2-dimethylbutylcyclopentane;propane?
The InChIKey is IWCIIBFKNMNCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22.C5H10.3C3H8/c1-4-11(2,3)9-10-7-5-6-8-10;1-2-4-5-3-1;3*1-3-2/h10H,4-9H2,1-3H3;1-5H2;3*3H2,1-2H3.
What are the key properties of cyclopentane;2,2-dimethylbutylcyclopentane;propane?
cyclopentane;2,2-dimethylbutylcyclopentane;propane has a molecular weight of 356.72 g/mol, XLogP of 10.20, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentane;2,2-dimethylbutylcyclopentane;propane is sourced from PubChem (CID 162289353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).