2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane

C17H44 — CID 162070166

IUPAC2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane
SMILESC.CC.CC.CC(C)(C)C.CCCC(C)(C)C
InChIInChI=1S/C7H16.C5H12.2C2H6.CH4/c1-5-6-7(2,3)4;1-5(2,3)4;2*1-2;/h5-6H2,1-4H3;1-4H3;2*1-2H3;1H4
InChIKeyZAYYPRPXUVNTEF-UHFFFAOYSA-N
MW248.54 g/mol
LogP7.57
Rot. Bonds1

About 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane

2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane (PubChem CID 162070166) has the molecular formula C17H44 and a molecular weight of 248.54 g/mol. Its IUPAC name is 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane.

Molecular Properties

Compound Name2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane
PubChem CID162070166
Molecular FormulaC17H44
Molecular Weight248.54 g/mol
Exact Mass248.34
IUPAC Name2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane
SMILESC.CC.CC.CC(C)(C)C.CCCC(C)(C)C
InChIInChI=1S/C7H16.C5H12.2C2H6.CH4/c1-5-6-7(2,3)4;1-5(2,3)4;2*1-2;/h5-6H2,1-4H3;1-4H3;2*1-2H3;1H4
InChIKeyZAYYPRPXUVNTEF-UHFFFAOYSA-N
XLogP7.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500248.54
LogP ≤ 57.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane 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

bis(2,2-dimethylpentane);methane
CID 159859974
2,2-dimethylpentane;ethane;propane
CID 156751345
cyclohexane;2,2-dimethylpentane;ethane
CID 162252162
2,2-dimethylbutane;2,2-dimethylpentane;2,2-dimethylpropane;methane;2-methylpropane;2,2,3,3-tetramethylbutane;2,2,3-trimethylbutane
CID 159604083
dichlorozirconium;3,3-dimethylbutan-1-ol;2,2-dimethylpentane;bis(2,2-dimethylpropane);ethanol
CID 160757315
butane;2,2-dimethylpropane;ethane;propane
CID 142459037
ethane;3-ethyl-2,2,3-trimethylhexane;methane
CID 143664746
ethane;2,2,4,4-tetramethylheptane
CID 143291913
2,2-dimethylhexane
CID 169424592
2,2-dimethylpentane;3,3-dimethyl-1-propoxybutane;3,3-dimethyl-1-(2-propoxyethoxy)butane
CID 161233705
bis(2,2-dimethylpropane);ethane;methane
CID 161072251
2,2,7,7-tetramethyldecane
CID 57491596

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane?
The IUPAC name of 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane (CID 162070166) is 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane.
What is the SMILES notation for 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane?
The canonical SMILES for 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane is C.CC.CC.CC(C)(C)C.CCCC(C)(C)C.
What is the InChIKey of 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane?
The InChIKey is ZAYYPRPXUVNTEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16.C5H12.2C2H6.CH4/c1-5-6-7(2,3)4;1-5(2,3)4;2*1-2;/h5-6H2,1-4H3;1-4H3;2*1-2H3;1H4.
What are the key properties of 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane?
2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane has a molecular weight of 248.54 g/mol, XLogP of 7.57, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpentane;2,2-dimethylpropane;ethane;methane is sourced from PubChem (CID 162070166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).