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

C10H16OS — CID 143831998

IUPAC5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
SMILESCC1=CCCO1.CC1=CCCS1
InChIInChI=1S/C5H8O.C5H8S/c2*1-5-3-2-4-6-5/h2*3H,2,4H2,1H3
InChIKeyPURDSAHBKQAIMD-UHFFFAOYSA-N
MW184.30 g/mol
LogP3.34
Rot. Bonds

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

5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene (PubChem CID 143831998) has the molecular formula C10H16OS and a molecular weight of 184.30 g/mol. Its IUPAC name is 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene.

Molecular Properties

Compound Name5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
PubChem CID143831998
Molecular FormulaC10H16OS
Molecular Weight184.30 g/mol
Exact Mass184.09
IUPAC Name5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
SMILESCC1=CCCO1.CC1=CCCS1
InChIInChI=1S/C5H8O.C5H8S/c2*1-5-3-2-4-6-5/h2*3H,2,4H2,1H3
InChIKeyPURDSAHBKQAIMD-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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Related Compounds

5-Methyl-4-(2-methylthiolan-2-yl)sulfanyl-2,3-dihydrofuran
CID 20442813
3-[(2,5-Diethyl-2,3-dihydrofuran-3-yl)sulfanyl]-2,5-diethyl-2,3-dihydrofuran
CID 22472268
3-Butoxy-1-ethylsulfanyl-5,5-dimethylhex-3-ene
CID 88826520
4-Ethylsulfanyl-5-methyl-2,3-dihydrofuran
CID 123438719
6-methyl-3,4-dihydro-2H-pyran;6-methyl-3,4-dihydro-2H-thiopyran
CID 142051048
2-Methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene
CID 143663974
2-[(2,5-dimethyl-3H-furan-2-yl)methylsulfanylmethyl]-2,5-dimethyl-3H-furan
CID 150048162
(E)-2-[2-[(E)-but-2-en-2-yl]oxyethylsulfanyl]pent-2-ene
CID 154968497
(3S)-3-butylsulfanyl-2,3,5-trimethyl-2H-furan
CID 173382775
(2E)-2-butylidene-5-methylidene-1,4-oxathiepane
CID 173805487
(E)-3-(2-ethylsulfanylethoxy)hex-2-ene
CID 142831076
(4E,7Z)-4-(2-methylsulfanylethoxy)nona-1,4,7-triene
CID 142831171

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
The IUPAC name of 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene (CID 143831998) is 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene.
What is the SMILES notation for 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
The canonical SMILES for 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene is CC1=CCCO1.CC1=CCCS1.
What is the InChIKey of 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
The InChIKey is PURDSAHBKQAIMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O.C5H8S/c2*1-5-3-2-4-6-5/h2*3H,2,4H2,1H3.
What are the key properties of 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene?
5-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 5-methyl-2,3-dihydrofuran;5-methyl-2,3-dihydrothiophene is sourced from PubChem (CID 143831998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).