2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane

C25H52 — CID 14275206

IUPAC2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane
SMILESCCC(C)CCC(CCC(C)CCCC(C)C)C(C)CCCC(C)C
InChIInChI=1S/C25H52/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h20-25H,9-19H2,1-8H3
InChIKeyOFIAQLKCCAODLR-UHFFFAOYSA-N
MW352.69 g/mol
LogP9.13
Rot. Bonds16

About 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane

2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane (PubChem CID 14275206) has the molecular formula C25H52 and a molecular weight of 352.69 g/mol. Its IUPAC name is 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane.

Molecular Properties

Compound Name2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane
PubChem CID14275206
Molecular FormulaC25H52
Molecular Weight352.69 g/mol
Exact Mass352.41
IUPAC Name2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane
SMILESCCC(C)CCC(CCC(C)CCCC(C)C)C(C)CCCC(C)C
InChIInChI=1S/C25H52/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h20-25H,9-19H2,1-8H3
InChIKeyOFIAQLKCCAODLR-UHFFFAOYSA-N
XLogP9.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.69
LogP ≤ 59.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane?
The IUPAC name of 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane (CID 14275206) is 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane.
What is the SMILES notation for 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane?
The canonical SMILES for 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane is CCC(C)CCC(CCC(C)CCCC(C)C)C(C)CCCC(C)C.
What is the InChIKey of 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane?
The InChIKey is OFIAQLKCCAODLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H52/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h20-25H,9-19H2,1-8H3.
What are the key properties of 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane?
2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane has a molecular weight of 352.69 g/mol, XLogP of 9.13, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10,14-tetramethyl-7-(3-methylpentyl)pentadecane is sourced from PubChem (CID 14275206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).