N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide

C10H6N2OS2 — CID 2105100

IUPACN-(3-cyanothiophen-2-yl)thiophene-2-carboxamide
SMILESN#Cc1ccsc1NC(=O)c1cccs1
InChIInChI=1S/C10H6N2OS2/c11-6-7-3-5-15-10(7)12-9(13)8-2-1-4-14-8/h1-5H,(H,12,13)
InChIKeyUMIVALFFGSRDRM-UHFFFAOYSA-N
MW234.31 g/mol
LogP2.93
Rot. Bonds2

About N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide

N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide (PubChem CID 2105100) has the molecular formula C10H6N2OS2 and a molecular weight of 234.31 g/mol. Its IUPAC name is N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(3-cyanothiophen-2-yl)thiophene-2-carboxamide
PubChem CID2105100
Molecular FormulaC10H6N2OS2
Molecular Weight234.31 g/mol
Exact Mass233.99
IUPAC NameN-(3-cyanothiophen-2-yl)thiophene-2-carboxamide
SMILESN#Cc1ccsc1NC(=O)c1cccs1
InChIInChI=1S/C10H6N2OS2/c11-6-7-3-5-15-10(7)12-9(13)8-2-1-4-14-8/h1-5H,(H,12,13)
InChIKeyUMIVALFFGSRDRM-UHFFFAOYSA-N
XLogP2.93
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide?
The IUPAC name of N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide (CID 2105100) is N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide is N#Cc1ccsc1NC(=O)c1cccs1.
What is the InChIKey of N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide?
The InChIKey is UMIVALFFGSRDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N2OS2/c11-6-7-3-5-15-10(7)12-9(13)8-2-1-4-14-8/h1-5H,(H,12,13).
What are the key properties of N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide?
N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide has a molecular weight of 234.31 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanothiophen-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 2105100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).