3-ethyl-2-octan-3-ylfuran

C14H24O — CID 174501717

IUPAC3-ethyl-2-octan-3-ylfuran
SMILESCCCCCC(CC)c1occc1CC
InChIInChI=1S/C14H24O/c1-4-7-8-9-12(5-2)14-13(6-3)10-11-15-14/h10-12H,4-9H2,1-3H3
InChIKeyHSIHHJPHYOQLST-UHFFFAOYSA-N
MW208.34 g/mol
LogP4.92
Rot. Bonds7

About 3-ethyl-2-octan-3-ylfuran

3-ethyl-2-octan-3-ylfuran (PubChem CID 174501717) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 3-ethyl-2-octan-3-ylfuran.

Molecular Properties

Compound Name3-ethyl-2-octan-3-ylfuran
PubChem CID174501717
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name3-ethyl-2-octan-3-ylfuran
SMILESCCCCCC(CC)c1occc1CC
InChIInChI=1S/C14H24O/c1-4-7-8-9-12(5-2)14-13(6-3)10-11-15-14/h10-12H,4-9H2,1-3H3
InChIKeyHSIHHJPHYOQLST-UHFFFAOYSA-N
XLogP4.92
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-octan-3-ylfuran-2-carboxylic acid
CID 175418427
1-(3-methylfuran-2-yl)nonan-1-ol
CID 104800699
octan-3-ylbenzene
CID 519547
2,5-di(octan-3-yl)thiophene
CID 151127806
1-(3-bromofuran-2-yl)hexan-1-amine
CID 115861654
2-(3-methylfuran-2-yl)hexan-1-ol
CID 140985525
4-dodecan-3-ylphenol
CID 12820022
1-octan-3-yl-4-prop-1-en-2-ylbenzene
CID 144723929
1,3-dimethyl-2-octan-3-ylbenzene
CID 144744268
N-ethyl-1-(3-methylfuran-2-yl)octan-1-amine
CID 104805256
1-(3-methylfuran-2-yl)tridecylhydrazine
CID 105269333
5-ethyl-4-methyl-2-octan-3-ylpyridine
CID 174324902

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-octan-3-ylfuran?
The IUPAC name of 3-ethyl-2-octan-3-ylfuran (CID 174501717) is 3-ethyl-2-octan-3-ylfuran.
What is the SMILES notation for 3-ethyl-2-octan-3-ylfuran?
The canonical SMILES for 3-ethyl-2-octan-3-ylfuran is CCCCCC(CC)c1occc1CC.
What is the InChIKey of 3-ethyl-2-octan-3-ylfuran?
The InChIKey is HSIHHJPHYOQLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-4-7-8-9-12(5-2)14-13(6-3)10-11-15-14/h10-12H,4-9H2,1-3H3.
What are the key properties of 3-ethyl-2-octan-3-ylfuran?
3-ethyl-2-octan-3-ylfuran has a molecular weight of 208.34 g/mol, XLogP of 4.92, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-octan-3-ylfuran is sourced from PubChem (CID 174501717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).