2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide

C17H12N2OS2 — CID 174520036

IUPAC2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide
SMILESNC(=O)c1ccccc1-c1[nH]c2ccsc2c1-c1cccs1
InChIInChI=1S/C17H12N2OS2/c18-17(20)11-5-2-1-4-10(11)15-14(13-6-3-8-21-13)16-12(19-15)7-9-22-16/h1-9,19H,(H2,18,20)
InChIKeyIELNCODGNLLYTF-UHFFFAOYSA-N
MW324.43 g/mol
LogP4.72
Rot. Bonds3

About 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide

2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide (PubChem CID 174520036) has the molecular formula C17H12N2OS2 and a molecular weight of 324.43 g/mol. Its IUPAC name is 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide.

Molecular Properties

Compound Name2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide
PubChem CID174520036
Molecular FormulaC17H12N2OS2
Molecular Weight324.43 g/mol
Exact Mass324.04
IUPAC Name2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide
SMILESNC(=O)c1ccccc1-c1[nH]c2ccsc2c1-c1cccs1
InChIInChI=1S/C17H12N2OS2/c18-17(20)11-5-2-1-4-10(11)15-14(13-6-3-8-21-13)16-12(19-15)7-9-22-16/h1-9,19H,(H2,18,20)
InChIKeyIELNCODGNLLYTF-UHFFFAOYSA-N
XLogP4.72
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(3,5-dichlorophenyl)sulfanyl-4H-thieno[3,2-b]pyrrol-5-yl]benzamide
CID 175249422
2-[6-(2-ethylphenyl)sulfanyl-4H-thieno[3,2-b]pyrrol-5-yl]benzamide
CID 174533177
3-methyl-2-thiophen-2-ylbenzamide
CID 67400493
2-(1,3-thiazol-2-yl)benzamide;hydrobromide
CID 143596918
2-[(2-thiophen-2-ylphenyl)methylsulfinyl]acetamide
CID 11623289
2-[(S)-(2-thiophen-2-ylphenyl)methylsulfinyl]acetamide
CID 124567027
N-oxo-2-thiophen-2-ylbenzamide
CID 134287051
7-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
CID 67551476
(3-phenyl-2-thiophen-2-ylphenyl) carbamate
CID 154235566
2-(1H-benzimidazol-2-yl)benzamide
CID 23510026
(3,5-diamino-4-thiophen-2-ylphenyl)-phenylmethanone
CID 174504701
2-(2,6-dichlorophenyl)benzamide
CID 67032434

Frequently Asked Questions

What is the IUPAC name of 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide?
The IUPAC name of 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide (CID 174520036) is 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide.
What is the SMILES notation for 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide?
The canonical SMILES for 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide is NC(=O)c1ccccc1-c1[nH]c2ccsc2c1-c1cccs1.
What is the InChIKey of 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide?
The InChIKey is IELNCODGNLLYTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2OS2/c18-17(20)11-5-2-1-4-10(11)15-14(13-6-3-8-21-13)16-12(19-15)7-9-22-16/h1-9,19H,(H2,18,20).
What are the key properties of 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide?
2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide has a molecular weight of 324.43 g/mol, XLogP of 4.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-thiophen-2-yl-4H-thieno[3,2-b]pyrrol-5-yl)benzamide is sourced from PubChem (CID 174520036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).