2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran

C14H22O2S — CID 22472262

IUPAC2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran
SMILESCC(C)C1OC=CC1SC1C=COC1C(C)C
InChIInChI=1S/C14H22O2S/c1-9(2)13-11(5-7-15-13)17-12-6-8-16-14(12)10(3)4/h5-14H,1-4H3
InChIKeyFKNULNWTUYTVCJ-UHFFFAOYSA-N
MW254.39 g/mol
LogP3.59
Rot. Bonds4

About 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran

2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran (PubChem CID 22472262) has the molecular formula C14H22O2S and a molecular weight of 254.39 g/mol. Its IUPAC name is 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran.

Molecular Properties

Compound Name2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran
PubChem CID22472262
Molecular FormulaC14H22O2S
Molecular Weight254.39 g/mol
Exact Mass254.13
IUPAC Name2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran
SMILESCC(C)C1OC=CC1SC1C=COC1C(C)C
InChIInChI=1S/C14H22O2S/c1-9(2)13-11(5-7-15-13)17-12-6-8-16-14(12)10(3)4/h5-14H,1-4H3
InChIKeyFKNULNWTUYTVCJ-UHFFFAOYSA-N
XLogP3.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.39
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran?
The IUPAC name of 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran (CID 22472262) is 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran.
What is the SMILES notation for 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran?
The canonical SMILES for 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran is CC(C)C1OC=CC1SC1C=COC1C(C)C.
What is the InChIKey of 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran?
The InChIKey is FKNULNWTUYTVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2S/c1-9(2)13-11(5-7-15-13)17-12-6-8-16-14(12)10(3)4/h5-14H,1-4H3.
What are the key properties of 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran?
2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran has a molecular weight of 254.39 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-3-[(2-propan-2-yl-2,3-dihydrofuran-3-yl)sulfanyl]-2,3-dihydrofuran is sourced from PubChem (CID 22472262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).