2,4,5,7-tetramethylundecane

C15H32 — CID 91373064

IUPAC2,4,5,7-tetramethylundecane
SMILESCCCCC(C)CC(C)C(C)CC(C)C
InChIInChI=1S/C15H32/c1-7-8-9-13(4)11-15(6)14(5)10-12(2)3/h12-15H,7-11H2,1-6H3
InChIKeyDMPNGYAMMNUAHM-UHFFFAOYSA-N
MW212.42 g/mol
LogP5.52
Rot. Bonds8

About 2,4,5,7-tetramethylundecane

2,4,5,7-tetramethylundecane (PubChem CID 91373064) has the molecular formula C15H32 and a molecular weight of 212.42 g/mol. Its IUPAC name is 2,4,5,7-tetramethylundecane.

Molecular Properties

Compound Name2,4,5,7-tetramethylundecane
PubChem CID91373064
Molecular FormulaC15H32
Molecular Weight212.42 g/mol
Exact Mass212.25
IUPAC Name2,4,5,7-tetramethylundecane
SMILESCCCCC(C)CC(C)C(C)CC(C)C
InChIInChI=1S/C15H32/c1-7-8-9-13(4)11-15(6)14(5)10-12(2)3/h12-15H,7-11H2,1-6H3
InChIKeyDMPNGYAMMNUAHM-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

Analyze 2,4,5,7-tetramethylundecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethyloctane;ethene
CID 156719555
2,4,6,10-tetramethyltetradecane
CID 123234776
2,4-dimethyltetradecane
CID 53423723
(4S)-2,4-dimethylicosane
CID 134952934
3,4,5,7-tetramethylundecane
CID 123179058
5,7,10-trimethyltetradecane
CID 91033593
3,5,6-trimethyldecane
CID 57490917
2,4,5-trimethyldodecane
CID 123969029
2,4-dimethylnonan-5-amine
CID 123957338
5,9-diethyl-7-(2-methylpropyl)tridecane
CID 173141748
9-butyl-7-methylhexadecane
CID 90905022
(4S,6S,8S)-2,4,6,8-tetramethyltetracosane
CID 141213214

Frequently Asked Questions

What is the IUPAC name of 2,4,5,7-tetramethylundecane?
The IUPAC name of 2,4,5,7-tetramethylundecane (CID 91373064) is 2,4,5,7-tetramethylundecane.
What is the SMILES notation for 2,4,5,7-tetramethylundecane?
The canonical SMILES for 2,4,5,7-tetramethylundecane is CCCCC(C)CC(C)C(C)CC(C)C.
What is the InChIKey of 2,4,5,7-tetramethylundecane?
The InChIKey is DMPNGYAMMNUAHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32/c1-7-8-9-13(4)11-15(6)14(5)10-12(2)3/h12-15H,7-11H2,1-6H3.
What are the key properties of 2,4,5,7-tetramethylundecane?
2,4,5,7-tetramethylundecane 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 2,4,5,7-tetramethylundecane is sourced from PubChem (CID 91373064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).