2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane

C11H24OS — CID 88562947

IUPAC2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane
SMILESCCCC(C)(C)S(=O)C(C)(C)CC
InChIInChI=1S/C11H24OS/c1-7-9-11(5,6)13(12)10(3,4)8-2/h7-9H2,1-6H3
InChIKeyKALMYVSGRCUYLA-UHFFFAOYSA-N
MW204.38 g/mol
LogP3.50
Rot. Bonds5

About 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane

2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane (PubChem CID 88562947) has the molecular formula C11H24OS and a molecular weight of 204.38 g/mol. Its IUPAC name is 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane.

Molecular Properties

Compound Name2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane
PubChem CID88562947
Molecular FormulaC11H24OS
Molecular Weight204.38 g/mol
Exact Mass204.15
IUPAC Name2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane
SMILESCCCC(C)(C)S(=O)C(C)(C)CC
InChIInChI=1S/C11H24OS/c1-7-9-11(5,6)13(12)10(3,4)8-2/h7-9H2,1-6H3
InChIKeyKALMYVSGRCUYLA-UHFFFAOYSA-N
XLogP3.50
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.38
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane 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

methyl 2-methylbutane-2-sulfinate
CID 134928940
3-ethyl-2,2-dimethyl-3-propan-2-ylhexane
CID 57491483
2-methyl-2-methylsulfinylhexane
CID 89314102
CID 101008751
CID 101008751
3,3-dimethylhexane
CID 11233
2,2-dimethylpentane;ethane;propane
CID 156751345
2,2-dimethylpentane-1-sulfinic acid
CID 91240429
CID 123515274
CID 123515274
2-methylhexane-2-sulfinamide
CID 123826931
(3S)-3-ethyl-2,3-dimethylhexane
CID 158040075
3,5,5-trimethyloctan-2-amine
CID 123362443
O-(3-methylhexan-3-yl)hydroxylamine
CID 163872522

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane?
The IUPAC name of 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane (CID 88562947) is 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane.
What is the SMILES notation for 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane?
The canonical SMILES for 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane is CCCC(C)(C)S(=O)C(C)(C)CC.
What is the InChIKey of 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane?
The InChIKey is KALMYVSGRCUYLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24OS/c1-7-9-11(5,6)13(12)10(3,4)8-2/h7-9H2,1-6H3.
What are the key properties of 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane?
2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane has a molecular weight of 204.38 g/mol, XLogP of 3.50, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-methylbutan-2-ylsulfinyl)pentane is sourced from PubChem (CID 88562947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).