5-thiophen-2-yl-1H-pyrrole-2-carboxamide

C9H8N2OS — CID 174655448

IUPAC5-thiophen-2-yl-1H-pyrrole-2-carboxamide
SMILESNC(=O)c1ccc(-c2cccs2)[nH]1
InChIInChI=1S/C9H8N2OS/c10-9(12)7-4-3-6(11-7)8-2-1-5-13-8/h1-5,11H,(H2,10,12)
InChIKeyRWPDMLWSCLOQEV-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.84
Rot. Bonds2

About 5-thiophen-2-yl-1H-pyrrole-2-carboxamide

5-thiophen-2-yl-1H-pyrrole-2-carboxamide (PubChem CID 174655448) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 5-thiophen-2-yl-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name5-thiophen-2-yl-1H-pyrrole-2-carboxamide
PubChem CID174655448
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name5-thiophen-2-yl-1H-pyrrole-2-carboxamide
SMILESNC(=O)c1ccc(-c2cccs2)[nH]1
InChIInChI=1S/C9H8N2OS/c10-9(12)7-4-3-6(11-7)8-2-1-5-13-8/h1-5,11H,(H2,10,12)
InChIKeyRWPDMLWSCLOQEV-UHFFFAOYSA-N
XLogP1.84
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-yl-1H-pyrrole-2-carboxamide?
The IUPAC name of 5-thiophen-2-yl-1H-pyrrole-2-carboxamide (CID 174655448) is 5-thiophen-2-yl-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 5-thiophen-2-yl-1H-pyrrole-2-carboxamide?
The canonical SMILES for 5-thiophen-2-yl-1H-pyrrole-2-carboxamide is NC(=O)c1ccc(-c2cccs2)[nH]1.
What is the InChIKey of 5-thiophen-2-yl-1H-pyrrole-2-carboxamide?
The InChIKey is RWPDMLWSCLOQEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c10-9(12)7-4-3-6(11-7)8-2-1-5-13-8/h1-5,11H,(H2,10,12).
What are the key properties of 5-thiophen-2-yl-1H-pyrrole-2-carboxamide?
5-thiophen-2-yl-1H-pyrrole-2-carboxamide has a molecular weight of 192.24 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-yl-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 174655448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).