2,5-Diethyl-3-propan-2-ylfuran

C11H18O — CID 150761031

IUPAC2,5-diethyl-3-propan-2-ylfuran
SMILESCCC1=CC(=C(O1)CC)C(C)C
InChIInChI=1S/C11H18O/c1-5-9-7-10(8(3)4)11(6-2)12-9/h7-8H,5-6H2,1-4H3
InChIKeyJXVJREYYHZICLF-UHFFFAOYSA-N
MW166.26 g/mol
LogP3.80
Rot. Bonds3

About 2,5-Diethyl-3-propan-2-ylfuran

2,5-Diethyl-3-propan-2-ylfuran (PubChem CID 150761031) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 2,5-diethyl-3-propan-2-ylfuran.

Molecular Properties

Compound Name2,5-Diethyl-3-propan-2-ylfuran
PubChem CID150761031
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name2,5-diethyl-3-propan-2-ylfuran
SMILESCCC1=CC(=C(O1)CC)C(C)C
InChIInChI=1S/C11H18O/c1-5-9-7-10(8(3)4)11(6-2)12-9/h7-8H,5-6H2,1-4H3
InChIKeyJXVJREYYHZICLF-UHFFFAOYSA-N
XLogP3.80
TPSA13.10 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity131

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-Acetyl-2,5-dimethylfuran
CID 61527
2-Ethyl-5-methylfuran
CID 74346
2-Heptylfuran
CID 19603
2,3-Dimethylbenzofuran
CID 2734646
2-Acetyl-3,5-dimethylfuran
CID 579675
3-(5-Methyl-2-furyl)butanal
CID 3578033
2-Decylfuran
CID 12762300
2-Octylfuran
CID 77845
3-Methyl-2-(3-methylbut-2-enyl)-furan
CID 84825
2-Hexylfuran
CID 77408
2,5-Diphenylfuran
CID 70387
Furanogermenone
CID 6439596

Frequently Asked Questions

What is the IUPAC name of 2,5-Diethyl-3-propan-2-ylfuran?
The IUPAC name of 2,5-Diethyl-3-propan-2-ylfuran (CID 150761031) is 2,5-diethyl-3-propan-2-ylfuran.
What is the SMILES notation for 2,5-Diethyl-3-propan-2-ylfuran?
The canonical SMILES for 2,5-Diethyl-3-propan-2-ylfuran is CCC1=CC(=C(O1)CC)C(C)C.
What is the InChIKey of 2,5-Diethyl-3-propan-2-ylfuran?
The InChIKey is JXVJREYYHZICLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c1-5-9-7-10(8(3)4)11(6-2)12-9/h7-8H,5-6H2,1-4H3.
What are the key properties of 2,5-Diethyl-3-propan-2-ylfuran?
2,5-Diethyl-3-propan-2-ylfuran has a molecular weight of 166.26 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-Diethyl-3-propan-2-ylfuran is sourced from PubChem (CID 150761031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).