11-ethyl-3-methyltetradecane

C17H36 — CID 123200411

IUPAC11-ethyl-3-methyltetradecane
SMILESCCCC(CC)CCCCCCCC(C)CC
InChIInChI=1S/C17H36/c1-5-13-17(7-3)15-12-10-8-9-11-14-16(4)6-2/h16-17H,5-15H2,1-4H3
InChIKeyRAPOGJSXXKDXJE-UHFFFAOYSA-N
MW240.47 g/mol
LogP6.59
Rot. Bonds12

About 11-ethyl-3-methyltetradecane

11-ethyl-3-methyltetradecane (PubChem CID 123200411) has the molecular formula C17H36 and a molecular weight of 240.47 g/mol. Its IUPAC name is 11-ethyl-3-methyltetradecane.

Molecular Properties

Compound Name11-ethyl-3-methyltetradecane
PubChem CID123200411
Molecular FormulaC17H36
Molecular Weight240.47 g/mol
Exact Mass240.28
IUPAC Name11-ethyl-3-methyltetradecane
SMILESCCCC(CC)CCCCCCCC(C)CC
InChIInChI=1S/C17H36/c1-5-13-17(7-3)15-12-10-8-9-11-14-16(4)6-2/h16-17H,5-15H2,1-4H3
InChIKeyRAPOGJSXXKDXJE-UHFFFAOYSA-N
XLogP6.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.47
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

9-ethyl-3-methyltridecane
CID 54105230
7-ethylpentadecane;5-ethylundecane;3-methylundecane;nonane;tridecane;undecane
CID 161368370
4-ethylheptane;3-methylheptane
CID 143099611
3-ethyl-10-methyldodecane
CID 54169175
13-ethyl-3,8-dimethyloctadecane
CID 123214629
3-ethyl-8-methyldecane
CID 57490930
7-ethyl-3-methylundecane
CID 57085432
10-ethyl-2-methyltridecane
CID 173195663
4-ethylhexadecane
CID 528433
4-ethylnonadecane
CID 22223766
3-methyl-7-propylundecane
CID 123449834
19-ethyl-15-methyltetratriacontane
CID 123150994

Frequently Asked Questions

What is the IUPAC name of 11-ethyl-3-methyltetradecane?
The IUPAC name of 11-ethyl-3-methyltetradecane (CID 123200411) is 11-ethyl-3-methyltetradecane.
What is the SMILES notation for 11-ethyl-3-methyltetradecane?
The canonical SMILES for 11-ethyl-3-methyltetradecane is CCCC(CC)CCCCCCCC(C)CC.
What is the InChIKey of 11-ethyl-3-methyltetradecane?
The InChIKey is RAPOGJSXXKDXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36/c1-5-13-17(7-3)15-12-10-8-9-11-14-16(4)6-2/h16-17H,5-15H2,1-4H3.
What are the key properties of 11-ethyl-3-methyltetradecane?
11-ethyl-3-methyltetradecane has a molecular weight of 240.47 g/mol, XLogP of 6.59, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethyl-3-methyltetradecane is sourced from PubChem (CID 123200411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).