6-ethyl-2,3-dimethyldecane

C14H30 — CID 57491764

IUPAC6-ethyl-2,3-dimethyldecane
SMILESCCCCC(CC)CCC(C)C(C)C
InChIInChI=1S/C14H30/c1-6-8-9-14(7-2)11-10-13(5)12(3)4/h12-14H,6-11H2,1-5H3
InChIKeyBZBICHPTRJIJRU-UHFFFAOYSA-N
MW198.39 g/mol
LogP5.28
Rot. Bonds8

About 6-ethyl-2,3-dimethyldecane

6-ethyl-2,3-dimethyldecane (PubChem CID 57491764) has the molecular formula C14H30 and a molecular weight of 198.39 g/mol. Its IUPAC name is 6-ethyl-2,3-dimethyldecane.

Molecular Properties

Compound Name6-ethyl-2,3-dimethyldecane
PubChem CID57491764
Molecular FormulaC14H30
Molecular Weight198.39 g/mol
Exact Mass198.23
IUPAC Name6-ethyl-2,3-dimethyldecane
SMILESCCCCC(CC)CCC(C)C(C)C
InChIInChI=1S/C14H30/c1-6-8-9-14(7-2)11-10-13(5)12(3)4/h12-14H,6-11H2,1-5H3
InChIKeyBZBICHPTRJIJRU-UHFFFAOYSA-N
XLogP5.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500198.39
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2,3-dimethyldecane?
The IUPAC name of 6-ethyl-2,3-dimethyldecane (CID 57491764) is 6-ethyl-2,3-dimethyldecane.
What is the SMILES notation for 6-ethyl-2,3-dimethyldecane?
The canonical SMILES for 6-ethyl-2,3-dimethyldecane is CCCCC(CC)CCC(C)C(C)C.
What is the InChIKey of 6-ethyl-2,3-dimethyldecane?
The InChIKey is BZBICHPTRJIJRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30/c1-6-8-9-14(7-2)11-10-13(5)12(3)4/h12-14H,6-11H2,1-5H3.
What are the key properties of 6-ethyl-2,3-dimethyldecane?
6-ethyl-2,3-dimethyldecane has a molecular weight of 198.39 g/mol, XLogP of 5.28, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2,3-dimethyldecane is sourced from PubChem (CID 57491764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).