2,3-dimethylthiophene;ethane

C10H20S — CID 54075062

IUPAC2,3-dimethylthiophene;ethane
SMILESCC.CC.Cc1ccsc1C
InChIInChI=1S/C6H8S.2C2H6/c1-5-3-4-7-6(5)2;2*1-2/h3-4H,1-2H3;2*1-2H3
InChIKeyMJCPPVYXCHDYCT-UHFFFAOYSA-N
MW172.34 g/mol
LogP4.42
Rot. Bonds

About 2,3-dimethylthiophene;ethane

2,3-dimethylthiophene;ethane (PubChem CID 54075062) has the molecular formula C10H20S and a molecular weight of 172.34 g/mol. Its IUPAC name is 2,3-dimethylthiophene;ethane.

Molecular Properties

Compound Name2,3-dimethylthiophene;ethane
PubChem CID54075062
Molecular FormulaC10H20S
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name2,3-dimethylthiophene;ethane
SMILESCC.CC.Cc1ccsc1C
InChIInChI=1S/C6H8S.2C2H6/c1-5-3-4-7-6(5)2;2*1-2/h3-4H,1-2H3;2*1-2H3
InChIKeyMJCPPVYXCHDYCT-UHFFFAOYSA-N
XLogP4.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dimethylthiophene;ethane;3-methylthiophene
CID 144970372
carbanide;2,3-dimethylthiophene;2,3,4,5-tetramethylthiophene;tris(yttrium)
CID 165102969
ethane;2-ethenyl-3-methylthiophene;prop-1-ene
CID 143900097
2-(bromomethyl)-3-methylthiophene
CID 18463526
3-methylthiophen-2-amine
CID 14536436
2,3-dimethylfuran;2,3-dimethylthiophene;2-methyl-3-propan-2-ylfuran;2-methyl-3-propan-2-ylthiophene
CID 159099948
ethane;3-methylthiophene-2-carboxylic acid
CID 142138544
2-methylthiophene-3-carbonitrile
CID 12565787
N,N-dimethylacetamide;N,N-dimethylmethanamine;1,2-dimethylpyrrole;2,3-dimethylthiophene;ethane;toluene
CID 159332143
ethane;6-methylthieno[3,4-b]thiophene
CID 145101912
3-chloro-2-methylthiophene;cyclohexane
CID 174875843
trifluoro-(2-methylthiophen-3-yl)boranuide
CID 102829045

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylthiophene;ethane?
The IUPAC name of 2,3-dimethylthiophene;ethane (CID 54075062) is 2,3-dimethylthiophene;ethane.
What is the SMILES notation for 2,3-dimethylthiophene;ethane?
The canonical SMILES for 2,3-dimethylthiophene;ethane is CC.CC.Cc1ccsc1C.
What is the InChIKey of 2,3-dimethylthiophene;ethane?
The InChIKey is MJCPPVYXCHDYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8S.2C2H6/c1-5-3-4-7-6(5)2;2*1-2/h3-4H,1-2H3;2*1-2H3.
What are the key properties of 2,3-dimethylthiophene;ethane?
2,3-dimethylthiophene;ethane has a molecular weight of 172.34 g/mol, XLogP of 4.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylthiophene;ethane is sourced from PubChem (CID 54075062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).