5-butyl-5-ethyl-4-methoxy-2H-furan

C11H20O2 — CID 12907856

IUPAC5-butyl-5-ethyl-4-methoxy-2H-furan
SMILESCCCCC1(CC)OCC=C1OC
InChIInChI=1S/C11H20O2/c1-4-6-8-11(5-2)10(12-3)7-9-13-11/h7H,4-6,8-9H2,1-3H3
InChIKeyGBVCNRJZMQWIBQ-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.89
Rot. Bonds5

About 5-butyl-5-ethyl-4-methoxy-2H-furan

5-butyl-5-ethyl-4-methoxy-2H-furan (PubChem CID 12907856) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 5-butyl-5-ethyl-4-methoxy-2H-furan.

Molecular Properties

Compound Name5-butyl-5-ethyl-4-methoxy-2H-furan
PubChem CID12907856
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name5-butyl-5-ethyl-4-methoxy-2H-furan
SMILESCCCCC1(CC)OCC=C1OC
InChIInChI=1S/C11H20O2/c1-4-6-8-11(5-2)10(12-3)7-9-13-11/h7H,4-6,8-9H2,1-3H3
InChIKeyGBVCNRJZMQWIBQ-UHFFFAOYSA-N
XLogP2.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Methoxy-1-oxaspiro[4.5]dec-3-ene
CID 13300108
6-Methoxy-1-oxaspiro[4.5]dec-6-ene
CID 15946867
2-Cyclohexyl-3-methoxy-2,5-dihydrofuran
CID 102055860
(E)-8-(2-methoxyprop-2-enoxy)-4,8-dimethylnon-3-ene
CID 88982026
2-[(E)-2-ethenoxypent-1-enyl]-2-ethyloxolane
CID 140137706
1,2-Diethoxybicyclo[2.2.1]hept-2-ene
CID 141188577
(4S)-2-(2,3-dihydrofuran-5-yl)-4-methyloxane
CID 163520264
[(Z)-1,3-dimethoxy-4,4-dimethylpent-2-enyl]cyclopentane
CID 169647502
5-(1-Prop-2-enoxycyclopentyl)-2,3-dihydrofuran
CID 10488064
4-(1-Ethoxyethenyl)-1-methyl-4-prop-2-enoxycyclohexene
CID 10513242
5-(1-Prop-2-enoxycyclohexyl)-2,3-dihydrofuran
CID 10536354
6-(1-prop-2-enoxycyclohexyl)-3,4-dihydro-2H-pyran
CID 10537016

Frequently Asked Questions

What is the IUPAC name of 5-butyl-5-ethyl-4-methoxy-2H-furan?
The IUPAC name of 5-butyl-5-ethyl-4-methoxy-2H-furan (CID 12907856) is 5-butyl-5-ethyl-4-methoxy-2H-furan.
What is the SMILES notation for 5-butyl-5-ethyl-4-methoxy-2H-furan?
The canonical SMILES for 5-butyl-5-ethyl-4-methoxy-2H-furan is CCCCC1(CC)OCC=C1OC.
What is the InChIKey of 5-butyl-5-ethyl-4-methoxy-2H-furan?
The InChIKey is GBVCNRJZMQWIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-4-6-8-11(5-2)10(12-3)7-9-13-11/h7H,4-6,8-9H2,1-3H3.
What are the key properties of 5-butyl-5-ethyl-4-methoxy-2H-furan?
5-butyl-5-ethyl-4-methoxy-2H-furan has a molecular weight of 184.28 g/mol, XLogP of 2.89, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-5-ethyl-4-methoxy-2H-furan is sourced from PubChem (CID 12907856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).