3,6-dimethyl-5-propan-2-yldecane

C15H32 — CID 123254389

IUPAC3,6-dimethyl-5-propan-2-yldecane
SMILESCCCCC(C)C(CC(C)CC)C(C)C
InChIInChI=1S/C15H32/c1-7-9-10-14(6)15(12(3)4)11-13(5)8-2/h12-15H,7-11H2,1-6H3
InChIKeyXPEDFFGNWRWFSG-UHFFFAOYSA-N
MW212.42 g/mol
LogP5.52
Rot. Bonds8

About 3,6-dimethyl-5-propan-2-yldecane

3,6-dimethyl-5-propan-2-yldecane (PubChem CID 123254389) has the molecular formula C15H32 and a molecular weight of 212.42 g/mol. Its IUPAC name is 3,6-dimethyl-5-propan-2-yldecane.

Molecular Properties

Compound Name3,6-dimethyl-5-propan-2-yldecane
PubChem CID123254389
Molecular FormulaC15H32
Molecular Weight212.42 g/mol
Exact Mass212.25
IUPAC Name3,6-dimethyl-5-propan-2-yldecane
SMILESCCCCC(C)C(CC(C)CC)C(C)C
InChIInChI=1S/C15H32/c1-7-9-10-14(6)15(12(3)4)11-13(5)8-2/h12-15H,7-11H2,1-6H3
InChIKeyXPEDFFGNWRWFSG-UHFFFAOYSA-N
XLogP5.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.42
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3,5,6-trimethyldecane
CID 57490917
5-methyl-3-propan-2-ylheptan-2-amine
CID 62913811
7-ethyl-2,4,8-trimethyl-6-(3-methylpentan-2-yl)dodecane
CID 123225543
5-methyl-4-propan-2-yltetradecane
CID 123996280
3-methyl-N-propan-2-ylnonan-5-amine
CID 79413294
alumane;2,3-dimethylheptane
CID 174508099
(3R)-2,3-dimethylheptane;ethane
CID 163241846
2,3-dimethylheptane;ethane
CID 156648444
3-methylheptane;nickel
CID 158967838
3,7-dimethyl-6-(2-methylpropyl)undecane
CID 123589473
6-butyl-3,7-dimethylundecane
CID 123359248
5-butyl-3-methyldodecane
CID 91590933

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-5-propan-2-yldecane?
The IUPAC name of 3,6-dimethyl-5-propan-2-yldecane (CID 123254389) is 3,6-dimethyl-5-propan-2-yldecane.
What is the SMILES notation for 3,6-dimethyl-5-propan-2-yldecane?
The canonical SMILES for 3,6-dimethyl-5-propan-2-yldecane is CCCCC(C)C(CC(C)CC)C(C)C.
What is the InChIKey of 3,6-dimethyl-5-propan-2-yldecane?
The InChIKey is XPEDFFGNWRWFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32/c1-7-9-10-14(6)15(12(3)4)11-13(5)8-2/h12-15H,7-11H2,1-6H3.
What are the key properties of 3,6-dimethyl-5-propan-2-yldecane?
3,6-dimethyl-5-propan-2-yldecane has a molecular weight of 212.42 g/mol, XLogP of 5.52, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-5-propan-2-yldecane is sourced from PubChem (CID 123254389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).