2,3-dimethylthiophene;ethane;3-methylthiophene

C15H26S2 — CID 144970372

IUPAC2,3-dimethylthiophene;ethane;3-methylthiophene
SMILESCC.CC.Cc1ccsc1.Cc1ccsc1C
InChIInChI=1S/C6H8S.C5H6S.2C2H6/c1-5-3-4-7-6(5)2;1-5-2-3-6-4-5;2*1-2/h3-4H,1-2H3;2-4H,1H3;2*1-2H3
InChIKeyWYIYLGQXVZGVHZ-UHFFFAOYSA-N
MW270.51 g/mol
LogP6.47
Rot. Bonds

About 2,3-dimethylthiophene;ethane;3-methylthiophene

2,3-dimethylthiophene;ethane;3-methylthiophene (PubChem CID 144970372) has the molecular formula C15H26S2 and a molecular weight of 270.51 g/mol. Its IUPAC name is 2,3-dimethylthiophene;ethane;3-methylthiophene.

Molecular Properties

Compound Name2,3-dimethylthiophene;ethane;3-methylthiophene
PubChem CID144970372
Molecular FormulaC15H26S2
Molecular Weight270.51 g/mol
Exact Mass270.15
IUPAC Name2,3-dimethylthiophene;ethane;3-methylthiophene
SMILESCC.CC.Cc1ccsc1.Cc1ccsc1C
InChIInChI=1S/C6H8S.C5H6S.2C2H6/c1-5-3-4-7-6(5)2;1-5-2-3-6-4-5;2*1-2/h3-4H,1-2H3;2-4H,1H3;2*1-2H3
InChIKeyWYIYLGQXVZGVHZ-UHFFFAOYSA-N
XLogP6.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.51
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethylthiophene;ethane
CID 54075062
ethane;methane;3-methylthiophene
CID 143325048
ethane;2-methylthiophene;3-methylthiophene
CID 142916163
carbanide;2,3-dimethylthiophene;2,3,4,5-tetramethylthiophene;tris(yttrium)
CID 165102969
N-[(3-methylthiophen-2-yl)methyl]-1-thiophen-3-ylmethanamine
CID 60744110
(2-methylthiophen-3-yl)-thiophen-3-ylmethanol
CID 102829147
2-(3-methylthiophen-2-yl)-1-thiophen-3-ylpropan-2-ol
CID 65148928
ethane;2-ethenyl-3-methylthiophene;prop-1-ene
CID 143900097
2-(bromomethyl)-3-methylthiophene
CID 18463526
3-chloro-2-methylthiophene;cyclohexane
CID 174875843
ethane;6-methylthieno[3,4-b]thiophene
CID 145101912
3-methylthiophen-2-amine
CID 14536436

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylthiophene;ethane;3-methylthiophene?
The IUPAC name of 2,3-dimethylthiophene;ethane;3-methylthiophene (CID 144970372) is 2,3-dimethylthiophene;ethane;3-methylthiophene.
What is the SMILES notation for 2,3-dimethylthiophene;ethane;3-methylthiophene?
The canonical SMILES for 2,3-dimethylthiophene;ethane;3-methylthiophene is CC.CC.Cc1ccsc1.Cc1ccsc1C.
What is the InChIKey of 2,3-dimethylthiophene;ethane;3-methylthiophene?
The InChIKey is WYIYLGQXVZGVHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8S.C5H6S.2C2H6/c1-5-3-4-7-6(5)2;1-5-2-3-6-4-5;2*1-2/h3-4H,1-2H3;2-4H,1H3;2*1-2H3.
What are the key properties of 2,3-dimethylthiophene;ethane;3-methylthiophene?
2,3-dimethylthiophene;ethane;3-methylthiophene has a molecular weight of 270.51 g/mol, XLogP of 6.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylthiophene;ethane;3-methylthiophene is sourced from PubChem (CID 144970372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).