10-ethyl-2-methyltridecane

C16H34 — CID 173195663

IUPAC10-ethyl-2-methyltridecane
SMILESCCCC(CC)CCCCCCCC(C)C
InChIInChI=1S/C16H34/c1-5-12-16(6-2)14-11-9-7-8-10-13-15(3)4/h15-16H,5-14H2,1-4H3
InChIKeyFUUKBUIPONIMHS-UHFFFAOYSA-N
MW226.45 g/mol
LogP6.20
Rot. Bonds11

About 10-ethyl-2-methyltridecane

10-ethyl-2-methyltridecane (PubChem CID 173195663) has the molecular formula C16H34 and a molecular weight of 226.45 g/mol. Its IUPAC name is 10-ethyl-2-methyltridecane.

Molecular Properties

Compound Name10-ethyl-2-methyltridecane
PubChem CID173195663
Molecular FormulaC16H34
Molecular Weight226.45 g/mol
Exact Mass226.27
IUPAC Name10-ethyl-2-methyltridecane
SMILESCCCC(CC)CCCCCCCC(C)C
InChIInChI=1S/C16H34/c1-5-12-16(6-2)14-11-9-7-8-10-13-15(3)4/h15-16H,5-14H2,1-4H3
InChIKeyFUUKBUIPONIMHS-UHFFFAOYSA-N
XLogP6.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500226.45
LogP ≤ 56.20
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

4-ethylhexadecane
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4-ethylnonadecane
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11-ethyl-3-methyltetradecane
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CID 545626
8-(3-ethylhexyl)hexadecane
CID 123944120
12-ethylhentriacontane
CID 91805956
15-ethyltetratriacontane
CID 23358557
7-ethyltetracosane
CID 22223872
7-ethyltetradecane
CID 529902
2-methyl-5-propyltridecane
CID 123255718
18-ethylhenicosan-1-ol
CID 87097708
(8R)-8-(methoxymethyl)-2-methylundecane
CID 118890150

Frequently Asked Questions

What is the IUPAC name of 10-ethyl-2-methyltridecane?
The IUPAC name of 10-ethyl-2-methyltridecane (CID 173195663) is 10-ethyl-2-methyltridecane.
What is the SMILES notation for 10-ethyl-2-methyltridecane?
The canonical SMILES for 10-ethyl-2-methyltridecane is CCCC(CC)CCCCCCCC(C)C.
What is the InChIKey of 10-ethyl-2-methyltridecane?
The InChIKey is FUUKBUIPONIMHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34/c1-5-12-16(6-2)14-11-9-7-8-10-13-15(3)4/h15-16H,5-14H2,1-4H3.
What are the key properties of 10-ethyl-2-methyltridecane?
10-ethyl-2-methyltridecane has a molecular weight of 226.45 g/mol, XLogP of 6.20, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethyl-2-methyltridecane is sourced from PubChem (CID 173195663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).