2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole

C14H15NS — CID 70937708

IUPAC2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole
SMILESCc1cc2ccc3cc(C(C)C)[nH]c3c2s1
InChIInChI=1S/C14H15NS/c1-8(2)12-7-10-4-5-11-6-9(3)16-14(11)13(10)15-12/h4-8,15H,1-3H3
InChIKeyWJNGQBLYKGTENI-UHFFFAOYSA-N
MW229.35 g/mol
LogP4.81
Rot. Bonds1

About 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole

2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole (PubChem CID 70937708) has the molecular formula C14H15NS and a molecular weight of 229.35 g/mol. Its IUPAC name is 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole.

Molecular Properties

Compound Name2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole
PubChem CID70937708
Molecular FormulaC14H15NS
Molecular Weight229.35 g/mol
Exact Mass229.09
IUPAC Name2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole
SMILESCc1cc2ccc3cc(C(C)C)[nH]c3c2s1
InChIInChI=1S/C14H15NS/c1-8(2)12-7-10-4-5-11-6-9(3)16-14(11)13(10)15-12/h4-8,15H,1-3H3
InChIKeyWJNGQBLYKGTENI-UHFFFAOYSA-N
XLogP4.81
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole?
The IUPAC name of 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole (CID 70937708) is 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole.
What is the SMILES notation for 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole?
The canonical SMILES for 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole is Cc1cc2ccc3cc(C(C)C)[nH]c3c2s1.
What is the InChIKey of 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole?
The InChIKey is WJNGQBLYKGTENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NS/c1-8(2)12-7-10-4-5-11-6-9(3)16-14(11)13(10)15-12/h4-8,15H,1-3H3.
What are the key properties of 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole?
2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole has a molecular weight of 229.35 g/mol, XLogP of 4.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-propan-2-yl-8H-thieno[3,2-g]indole is sourced from PubChem (CID 70937708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).