2-ethenyl-4H-thieno[2,3-b]indole

C12H9NS — CID 177063992

IUPAC2-ethenyl-4H-thieno[2,3-b]indole
SMILESC=Cc1cc2c([nH]c3ccccc32)s1
InChIInChI=1S/C12H9NS/c1-2-8-7-10-9-5-3-4-6-11(9)13-12(10)14-8/h2-7,13H,1H2
InChIKeyKOJLQNMHYSWMHR-UHFFFAOYSA-N
MW199.28 g/mol
LogP4.03
Rot. Bonds1

About 2-ethenyl-4H-thieno[2,3-b]indole

2-ethenyl-4H-thieno[2,3-b]indole (PubChem CID 177063992) has the molecular formula C12H9NS and a molecular weight of 199.28 g/mol. Its IUPAC name is 2-ethenyl-4H-thieno[2,3-b]indole.

Molecular Properties

Compound Name2-ethenyl-4H-thieno[2,3-b]indole
PubChem CID177063992
Molecular FormulaC12H9NS
Molecular Weight199.28 g/mol
Exact Mass199.05
IUPAC Name2-ethenyl-4H-thieno[2,3-b]indole
SMILESC=Cc1cc2c([nH]c3ccccc32)s1
InChIInChI=1S/C12H9NS/c1-2-8-7-10-9-5-3-4-6-11(9)13-12(10)14-8/h2-7,13H,1H2
InChIKeyKOJLQNMHYSWMHR-UHFFFAOYSA-N
XLogP4.03
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9H-carbazole
CID 66668984
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437
7,17,24,34-tetrazanonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1(20),2,4(16),5,8,10,12,14,18,21(33),22,25,27,29,31-pentadecaene
CID 58471811
bis(1H-azepine);9H-carbazole
CID 174976693
5,6-dideuterio-11,12-dihydroindolo[2,3-a]carbazole
CID 172776926
9H-carbazole;ethane
CID 91098062
bis(9H-carbazole);ethane
CID 145072085
9H-carbazole;prop-2-enamide
CID 174545742
bromomethane;9H-carbazole
CID 67594562
9H-carbazole;methanedithioic acid
CID 158299126
9H-carbazole;9-methylcarbazole
CID 142567226

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4H-thieno[2,3-b]indole?
The IUPAC name of 2-ethenyl-4H-thieno[2,3-b]indole (CID 177063992) is 2-ethenyl-4H-thieno[2,3-b]indole.
What is the SMILES notation for 2-ethenyl-4H-thieno[2,3-b]indole?
The canonical SMILES for 2-ethenyl-4H-thieno[2,3-b]indole is C=Cc1cc2c([nH]c3ccccc32)s1.
What is the InChIKey of 2-ethenyl-4H-thieno[2,3-b]indole?
The InChIKey is KOJLQNMHYSWMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NS/c1-2-8-7-10-9-5-3-4-6-11(9)13-12(10)14-8/h2-7,13H,1H2.
What are the key properties of 2-ethenyl-4H-thieno[2,3-b]indole?
2-ethenyl-4H-thieno[2,3-b]indole has a molecular weight of 199.28 g/mol, XLogP of 4.03, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4H-thieno[2,3-b]indole is sourced from PubChem (CID 177063992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).