6,10-diethyl-2,6,7,10,12-pentamethylpentadecane

C24H50 — CID 123590734

IUPAC6,10-diethyl-2,6,7,10,12-pentamethylpentadecane
SMILESCCCC(C)CC(C)(CC)CCC(C)C(C)(CC)CCCC(C)C
InChIInChI=1S/C24H50/c1-10-14-21(6)19-23(8,11-2)18-16-22(7)24(9,12-3)17-13-15-20(4)5/h20-22H,10-19H2,1-9H3
InChIKeyLDHLQESXTWJHJD-UHFFFAOYSA-N
MW338.66 g/mol
LogP8.89
Rot. Bonds14

About 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane

6,10-diethyl-2,6,7,10,12-pentamethylpentadecane (PubChem CID 123590734) has the molecular formula C24H50 and a molecular weight of 338.66 g/mol. Its IUPAC name is 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane.

Molecular Properties

Compound Name6,10-diethyl-2,6,7,10,12-pentamethylpentadecane
PubChem CID123590734
Molecular FormulaC24H50
Molecular Weight338.66 g/mol
Exact Mass338.39
IUPAC Name6,10-diethyl-2,6,7,10,12-pentamethylpentadecane
SMILESCCCC(C)CC(C)(CC)CCC(C)C(C)(CC)CCCC(C)C
InChIInChI=1S/C24H50/c1-10-14-21(6)19-23(8,11-2)18-16-22(7)24(9,12-3)17-13-15-20(4)5/h20-22H,10-19H2,1-9H3
InChIKeyLDHLQESXTWJHJD-UHFFFAOYSA-N
XLogP8.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.66
LogP ≤ 58.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane?
The IUPAC name of 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane (CID 123590734) is 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane.
What is the SMILES notation for 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane?
The canonical SMILES for 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane is CCCC(C)CC(C)(CC)CCC(C)C(C)(CC)CCCC(C)C.
What is the InChIKey of 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane?
The InChIKey is LDHLQESXTWJHJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50/c1-10-14-21(6)19-23(8,11-2)18-16-22(7)24(9,12-3)17-13-15-20(4)5/h20-22H,10-19H2,1-9H3.
What are the key properties of 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane?
6,10-diethyl-2,6,7,10,12-pentamethylpentadecane has a molecular weight of 338.66 g/mol, XLogP of 8.89, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,10-diethyl-2,6,7,10,12-pentamethylpentadecane is sourced from PubChem (CID 123590734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).