ethane;5-methylthieno[3,2-b]thiophene

C9H12S2 — CID 91311898

IUPACethane;5-methylthieno[3,2-b]thiophene
SMILESCC.Cc1cc2sccc2s1
InChIInChI=1S/C7H6S2.C2H6/c1-5-4-7-6(9-5)2-3-8-7;1-2/h2-4H,1H3;1-2H3
InChIKeyCTZGTPYJBWYNIB-UHFFFAOYSA-N
MW184.33 g/mol
LogP4.30
Rot. Bonds

About ethane;5-methylthieno[3,2-b]thiophene

ethane;5-methylthieno[3,2-b]thiophene (PubChem CID 91311898) has the molecular formula C9H12S2 and a molecular weight of 184.33 g/mol. Its IUPAC name is ethane;5-methylthieno[3,2-b]thiophene.

Molecular Properties

Compound Nameethane;5-methylthieno[3,2-b]thiophene
PubChem CID91311898
Molecular FormulaC9H12S2
Molecular Weight184.33 g/mol
Exact Mass184.04
IUPAC Nameethane;5-methylthieno[3,2-b]thiophene
SMILESCC.Cc1cc2sccc2s1
InChIInChI=1S/C7H6S2.C2H6/c1-5-4-7-6(9-5)2-3-8-7;1-2/h2-4H,1H3;1-2H3
InChIKeyCTZGTPYJBWYNIB-UHFFFAOYSA-N
XLogP4.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;5-methylthieno[3,2-b]thiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-dimethylthieno[3,2-b]thiophene;ethane
CID 144533203
thieno[3,2-b]thiophen-5-ylstannane
CID 149433263
7-methyl-6,18-dithiahexacyclo[11.11.0.02,10.05,9.014,22.017,21]tetracosa-1(13),2(10),3,5(9),7,11,14(22),15,17(21),19,23-undecaene
CID 58411635
2-methyl-N-(thieno[3,2-b]thiophen-5-ylmethyl)propan-2-amine
CID 80744863
5-prop-1-ynylthieno[3,2-b]thiophene
CID 135040771
(5-methylthiophen-3-yl)-thieno[3,2-b]thiophen-5-ylmethanol
CID 115807767
hydron;thieno[3,2-b]thiophene
CID 174437334
5-[chloro-(4-methylphenyl)methyl]thieno[3,2-b]thiophene
CID 80744734
2-methyl-5-[5-(2-methylthieno[3,2-b]thiophen-5-yl)thiophen-2-yl]thieno[3,2-b]thiophene
CID 89495689
2-bromo-1-thieno[3,2-b]thiophen-5-ylethanone
CID 80738942
5-[bromo-(3,4-dimethylphenyl)methyl]thieno[3,2-b]thiophene
CID 80745931
(2-methylphenyl)-thieno[3,2-b]thiophen-5-ylmethanamine
CID 115795113

Frequently Asked Questions

What is the IUPAC name of ethane;5-methylthieno[3,2-b]thiophene?
The IUPAC name of ethane;5-methylthieno[3,2-b]thiophene (CID 91311898) is ethane;5-methylthieno[3,2-b]thiophene.
What is the SMILES notation for ethane;5-methylthieno[3,2-b]thiophene?
The canonical SMILES for ethane;5-methylthieno[3,2-b]thiophene is CC.Cc1cc2sccc2s1.
What is the InChIKey of ethane;5-methylthieno[3,2-b]thiophene?
The InChIKey is CTZGTPYJBWYNIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6S2.C2H6/c1-5-4-7-6(9-5)2-3-8-7;1-2/h2-4H,1H3;1-2H3.
What are the key properties of ethane;5-methylthieno[3,2-b]thiophene?
ethane;5-methylthieno[3,2-b]thiophene has a molecular weight of 184.33 g/mol, XLogP of 4.30, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methylthieno[3,2-b]thiophene is sourced from PubChem (CID 91311898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).