3,5-diethyl-2-methylfuran;ethane

C11H20O — CID 143641869

IUPAC3,5-diethyl-2-methylfuran;ethane
SMILESCC.CCc1cc(CC)c(C)o1
InChIInChI=1S/C9H14O.C2H6/c1-4-8-6-9(5-2)10-7(8)3;1-2/h6H,4-5H2,1-3H3;1-2H3
InChIKeyWLQBZIFHXKNWMI-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.74
Rot. Bonds2

About 3,5-diethyl-2-methylfuran;ethane

3,5-diethyl-2-methylfuran;ethane (PubChem CID 143641869) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 3,5-diethyl-2-methylfuran;ethane.

Molecular Properties

Compound Name3,5-diethyl-2-methylfuran;ethane
PubChem CID143641869
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name3,5-diethyl-2-methylfuran;ethane
SMILESCC.CCc1cc(CC)c(C)o1
InChIInChI=1S/C9H14O.C2H6/c1-4-8-6-9(5-2)10-7(8)3;1-2/h6H,4-5H2,1-3H3;1-2H3
InChIKeyWLQBZIFHXKNWMI-UHFFFAOYSA-N
XLogP3.74
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,5-diethyl-2-propan-2-ylfuran
CID 155737592
propan-2-yl 5-ethyl-2-methylfuran-3-carboxylate
CID 139747350
ethane;5-ethyl-3-methyl-2-propan-2-ylfuran
CID 155737661
[5-(aminomethyl)-2-methylfuran-3-yl]methanol
CID 82502468
N'-[[5-(aminomethyl)-2-methylfuran-3-yl]methyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102997752
N-[[4-(ethylaminomethyl)-5-methylfuran-2-yl]methyl]-N-methylpropan-1-amine
CID 62417372
N-[[5-(aminomethyl)-2-methylfuran-3-yl]methyl]-N,2-diethylbutan-1-amine
CID 55072164
N-[[4-(aminomethyl)-5-methylfuran-2-yl]methyl]-N-methylpentan-1-amine
CID 62420758
N-[[4-(ethylaminomethyl)-5-methylfuran-2-yl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 62426427
N'-[[4-(aminomethyl)-5-methylfuran-2-yl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 62436717
N-[[4-(aminomethyl)-5-methylfuran-2-yl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 82952579
N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62439401

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-2-methylfuran;ethane?
The IUPAC name of 3,5-diethyl-2-methylfuran;ethane (CID 143641869) is 3,5-diethyl-2-methylfuran;ethane.
What is the SMILES notation for 3,5-diethyl-2-methylfuran;ethane?
The canonical SMILES for 3,5-diethyl-2-methylfuran;ethane is CC.CCc1cc(CC)c(C)o1.
What is the InChIKey of 3,5-diethyl-2-methylfuran;ethane?
The InChIKey is WLQBZIFHXKNWMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O.C2H6/c1-4-8-6-9(5-2)10-7(8)3;1-2/h6H,4-5H2,1-3H3;1-2H3.
What are the key properties of 3,5-diethyl-2-methylfuran;ethane?
3,5-diethyl-2-methylfuran;ethane has a molecular weight of 168.28 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-2-methylfuran;ethane is sourced from PubChem (CID 143641869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).