2-methyl-7H-thieno[3,2-f]indole

C11H9NS — CID 69039188

IUPAC2-methyl-7H-thieno[3,2-f]indole
SMILESCc1cc2cc3cc[nH]c3cc2s1
InChIInChI=1S/C11H9NS/c1-7-4-9-5-8-2-3-12-10(8)6-11(9)13-7/h2-6,12H,1H3
InChIKeyREAQAQWOFWLWCO-UHFFFAOYSA-N
MW187.27 g/mol
LogP3.69
Rot. Bonds

About 2-methyl-7H-thieno[3,2-f]indole

2-methyl-7H-thieno[3,2-f]indole (PubChem CID 69039188) has the molecular formula C11H9NS and a molecular weight of 187.27 g/mol. Its IUPAC name is 2-methyl-7H-thieno[3,2-f]indole.

Molecular Properties

Compound Name2-methyl-7H-thieno[3,2-f]indole
PubChem CID69039188
Molecular FormulaC11H9NS
Molecular Weight187.27 g/mol
Exact Mass187.05
IUPAC Name2-methyl-7H-thieno[3,2-f]indole
SMILESCc1cc2cc3cc[nH]c3cc2s1
InChIInChI=1S/C11H9NS/c1-7-4-9-5-8-2-3-12-10(8)6-11(9)13-7/h2-6,12H,1H3
InChIKeyREAQAQWOFWLWCO-UHFFFAOYSA-N
XLogP3.69
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.27
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7H-thieno[3,2-f]indole?
The IUPAC name of 2-methyl-7H-thieno[3,2-f]indole (CID 69039188) is 2-methyl-7H-thieno[3,2-f]indole.
What is the SMILES notation for 2-methyl-7H-thieno[3,2-f]indole?
The canonical SMILES for 2-methyl-7H-thieno[3,2-f]indole is Cc1cc2cc3cc[nH]c3cc2s1.
What is the InChIKey of 2-methyl-7H-thieno[3,2-f]indole?
The InChIKey is REAQAQWOFWLWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NS/c1-7-4-9-5-8-2-3-12-10(8)6-11(9)13-7/h2-6,12H,1H3.
What are the key properties of 2-methyl-7H-thieno[3,2-f]indole?
2-methyl-7H-thieno[3,2-f]indole has a molecular weight of 187.27 g/mol, XLogP of 3.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7H-thieno[3,2-f]indole is sourced from PubChem (CID 69039188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).