5-(2-methylindol-1-yl)thiophene-2-carboxamide

C14H12N2OS — CID 53015462

IUPAC5-(2-methylindol-1-yl)thiophene-2-carboxamide
SMILESCc1cc2ccccc2n1-c1ccc(C(N)=O)s1
InChIInChI=1S/C14H12N2OS/c1-9-8-10-4-2-3-5-11(10)16(9)13-7-6-12(18-13)14(15)17/h2-8H,1H3,(H2,15,17)
InChIKeyLQAIIYIJZRXOGH-UHFFFAOYSA-N
MW256.33 g/mol
LogP3.10
Rot. Bonds2

About 5-(2-methylindol-1-yl)thiophene-2-carboxamide

5-(2-methylindol-1-yl)thiophene-2-carboxamide (PubChem CID 53015462) has the molecular formula C14H12N2OS and a molecular weight of 256.33 g/mol. Its IUPAC name is 5-(2-methylindol-1-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(2-methylindol-1-yl)thiophene-2-carboxamide
PubChem CID53015462
Molecular FormulaC14H12N2OS
Molecular Weight256.33 g/mol
Exact Mass256.07
IUPAC Name5-(2-methylindol-1-yl)thiophene-2-carboxamide
SMILESCc1cc2ccccc2n1-c1ccc(C(N)=O)s1
InChIInChI=1S/C14H12N2OS/c1-9-8-10-4-2-3-5-11(10)16(9)13-7-6-12(18-13)14(15)17/h2-8H,1H3,(H2,15,17)
InChIKeyLQAIIYIJZRXOGH-UHFFFAOYSA-N
XLogP3.10
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methylindol-1-yl)thiophene-2-carboxamide?
The IUPAC name of 5-(2-methylindol-1-yl)thiophene-2-carboxamide (CID 53015462) is 5-(2-methylindol-1-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-(2-methylindol-1-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-(2-methylindol-1-yl)thiophene-2-carboxamide is Cc1cc2ccccc2n1-c1ccc(C(N)=O)s1.
What is the InChIKey of 5-(2-methylindol-1-yl)thiophene-2-carboxamide?
The InChIKey is LQAIIYIJZRXOGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2OS/c1-9-8-10-4-2-3-5-11(10)16(9)13-7-6-12(18-13)14(15)17/h2-8H,1H3,(H2,15,17).
What are the key properties of 5-(2-methylindol-1-yl)thiophene-2-carboxamide?
5-(2-methylindol-1-yl)thiophene-2-carboxamide has a molecular weight of 256.33 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylindol-1-yl)thiophene-2-carboxamide is sourced from PubChem (CID 53015462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).