2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane

C10H15NS — CID 170950785

IUPAC2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane
SMILESCC.Cc1cc2cc(C)sc2[nH]1
InChIInChI=1S/C8H9NS.C2H6/c1-5-3-7-4-6(2)10-8(7)9-5;1-2/h3-4,9H,1-2H3;1-2H3
InChIKeyZGDIKOGTHZYTGB-UHFFFAOYSA-N
MW181.30 g/mol
LogP3.87
Rot. Bonds

About 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane

2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane (PubChem CID 170950785) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane.

Molecular Properties

Compound Name2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane
PubChem CID170950785
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC Name2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane
SMILESCC.Cc1cc2cc(C)sc2[nH]1
InChIInChI=1S/C8H9NS.C2H6/c1-5-3-7-4-6(2)10-8(7)9-5;1-2/h3-4,9H,1-2H3;1-2H3
InChIKeyZGDIKOGTHZYTGB-UHFFFAOYSA-N
XLogP3.87
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-2-methylthieno[2,3-b]pyridine;2-iodo-5-methyl-6H-thieno[2,3-b]pyrrole
CID 143028445
4,10-dimethyl-5,9-dithia-7-azatricyclo[6.3.0.02,6]undeca-1(8),2(6),3,10-tetraene
CID 138667135
2,5-dimethylthieno[2,3-b]thiophene
CID 58807308
2,5-dimethylthieno[3,2-b]thiophene;ethane
CID 144533203
2,4,5-trimethyl-6H-thieno[2,3-b]pyrrole
CID 176804488
2,7-dimethyl-8H-pyrrolo[3,2-g][1,3]benzothiazole
CID 70937598
3,5-dimethyl-6H-thieno[2,3-b]pyrrole
CID 59683331
4,9-dimethyl-5,8-dithia-13,16-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1,3,6,9,11,14-hexaene;ethane
CID 144994363
3,6-dimethyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
CID 67557929
ethane;5-methoxy-2-methyl-1H-pyrrolo[2,3-c]pyridine
CID 170611768
2,6-dimethyl-1H-pyrrolo[3,2-c]pyridine;ethane
CID 156750914
5,6-dimethoxy-2-methyl-1H-indole;ethane
CID 171088058

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane?
The IUPAC name of 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane (CID 170950785) is 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane.
What is the SMILES notation for 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane?
The canonical SMILES for 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane is CC.Cc1cc2cc(C)sc2[nH]1.
What is the InChIKey of 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane?
The InChIKey is ZGDIKOGTHZYTGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NS.C2H6/c1-5-3-7-4-6(2)10-8(7)9-5;1-2/h3-4,9H,1-2H3;1-2H3.
What are the key properties of 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane?
2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane has a molecular weight of 181.30 g/mol, XLogP of 3.87, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-6H-thieno[2,3-b]pyrrole;ethane is sourced from PubChem (CID 170950785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).