11-ethyl-2,6,9-trimethyltridecane

C18H38 — CID 123326718

IUPAC11-ethyl-2,6,9-trimethyltridecane
SMILESCCC(CC)CC(C)CCC(C)CCCC(C)C
InChIInChI=1S/C18H38/c1-7-18(8-2)14-17(6)13-12-16(5)11-9-10-15(3)4/h15-18H,7-14H2,1-6H3
InChIKeyFWQQAADHQBCHKI-UHFFFAOYSA-N
MW254.50 g/mol
LogP6.69
Rot. Bonds11

About 11-ethyl-2,6,9-trimethyltridecane

11-ethyl-2,6,9-trimethyltridecane (PubChem CID 123326718) has the molecular formula C18H38 and a molecular weight of 254.50 g/mol. Its IUPAC name is 11-ethyl-2,6,9-trimethyltridecane.

Molecular Properties

Compound Name11-ethyl-2,6,9-trimethyltridecane
PubChem CID123326718
Molecular FormulaC18H38
Molecular Weight254.50 g/mol
Exact Mass254.30
IUPAC Name11-ethyl-2,6,9-trimethyltridecane
SMILESCCC(CC)CC(C)CCC(C)CCCC(C)C
InChIInChI=1S/C18H38/c1-7-18(8-2)14-17(6)13-12-16(5)11-9-10-15(3)4/h15-18H,7-14H2,1-6H3
InChIKeyFWQQAADHQBCHKI-UHFFFAOYSA-N
XLogP6.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.50
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-ethyl-2,8-dimethylicosane;2,6,9-trimethylhenicosane
CID 160563987
10-ethyl-2,6,12-trimethyloctacosane
CID 123697620
14-ethyl-2,6,7,10-tetramethylhexadecane
CID 159635838
2,6,10,14,18,22,26-heptamethyloctacosane
CID 6428605
2,5,9,13-tetramethyltetradecane
CID 58292409
11-ethyl-2,5,7-trimethyltetradecane
CID 123549571
2,6,10,15,19-pentamethylhenicosane
CID 6428617
ethane;4-ethyl-2,9,12-trimethyltridecane
CID 143342118
2,6,13-trimethylpentadecane
CID 123742386
2,4,10,15,19,23-hexamethyltetracosane
CID 71327414
5,9-dimethyldecan-3-ol
CID 545842
5,11-diethyl-7-methylpentadecane
CID 174871265

Frequently Asked Questions

What is the IUPAC name of 11-ethyl-2,6,9-trimethyltridecane?
The IUPAC name of 11-ethyl-2,6,9-trimethyltridecane (CID 123326718) is 11-ethyl-2,6,9-trimethyltridecane.
What is the SMILES notation for 11-ethyl-2,6,9-trimethyltridecane?
The canonical SMILES for 11-ethyl-2,6,9-trimethyltridecane is CCC(CC)CC(C)CCC(C)CCCC(C)C.
What is the InChIKey of 11-ethyl-2,6,9-trimethyltridecane?
The InChIKey is FWQQAADHQBCHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38/c1-7-18(8-2)14-17(6)13-12-16(5)11-9-10-15(3)4/h15-18H,7-14H2,1-6H3.
What are the key properties of 11-ethyl-2,6,9-trimethyltridecane?
11-ethyl-2,6,9-trimethyltridecane has a molecular weight of 254.50 g/mol, XLogP of 6.69, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethyl-2,6,9-trimethyltridecane is sourced from PubChem (CID 123326718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).