2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene

C10H16OS — CID 143663974

IUPAC2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
SMILESCC1=CCCS1.CC1CC=CO1
InChIInChI=1S/C5H8O.C5H8S/c2*1-5-3-2-4-6-5/h2,4-5H,3H2,1H3;3H,2,4H2,1H3
InChIKeyVKGXOHPQTDJFQI-UHFFFAOYSA-N
MW184.30 g/mol
LogP3.34
Rot. Bonds

About 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene

2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene (PubChem CID 143663974) has the molecular formula C10H16OS and a molecular weight of 184.30 g/mol. Its IUPAC name is 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene.

Molecular Properties

Compound Name2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
PubChem CID143663974
Molecular FormulaC10H16OS
Molecular Weight184.30 g/mol
Exact Mass184.09
IUPAC Name2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
SMILESCC1=CCCS1.CC1CC=CO1
InChIInChI=1S/C5H8O.C5H8S/c2*1-5-3-2-4-6-5/h2,4-5H,3H2,1H3;3H,2,4H2,1H3
InChIKeyVKGXOHPQTDJFQI-UHFFFAOYSA-N
XLogP3.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.30
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
The IUPAC name of 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene (CID 143663974) is 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene.
What is the SMILES notation for 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
The canonical SMILES for 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene is CC1=CCCS1.CC1CC=CO1.
What is the InChIKey of 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
The InChIKey is VKGXOHPQTDJFQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O.C5H8S/c2*1-5-3-2-4-6-5/h2,4-5H,3H2,1H3;3H,2,4H2,1H3.
What are the key properties of 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene has a molecular weight of 184.30 g/mol, XLogP of 3.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene is sourced from PubChem (CID 143663974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).