5-thiophen-2-ylthiophene-2-carbonitrile

C9H5NS2 — CID 2739839

IUPAC5-thiophen-2-ylthiophene-2-carbonitrile
SMILESN#Cc1ccc(-c2cccs2)s1
InChIInChI=1S/C9H5NS2/c10-6-7-3-4-9(12-7)8-2-1-5-11-8/h1-5H
InChIKeyANARYBGZNUMARH-UHFFFAOYSA-N
MW191.28 g/mol
LogP3.35
Rot. Bonds1

About 5-thiophen-2-ylthiophene-2-carbonitrile

5-thiophen-2-ylthiophene-2-carbonitrile (PubChem CID 2739839) has the molecular formula C9H5NS2 and a molecular weight of 191.28 g/mol. Its IUPAC name is 5-thiophen-2-ylthiophene-2-carbonitrile.

Molecular Properties

Compound Name5-thiophen-2-ylthiophene-2-carbonitrile
PubChem CID2739839
Molecular FormulaC9H5NS2
Molecular Weight191.28 g/mol
Exact Mass190.99
IUPAC Name5-thiophen-2-ylthiophene-2-carbonitrile
SMILESN#Cc1ccc(-c2cccs2)s1
InChIInChI=1S/C9H5NS2/c10-6-7-3-4-9(12-7)8-2-1-5-11-8/h1-5H
InChIKeyANARYBGZNUMARH-UHFFFAOYSA-N
XLogP3.35
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-thiophen-2-ylthiophene-2-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

5-[5-(5-cyanothiophen-2-yl)thiophen-2-yl]thiophene-2-carbonitrile
CID 11500375
1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-dihydrocyclopenta[c]pyrrole-3,6-dione;5-(5-thiophen-2-ylthiophen-2-yl)thiophene-2-carbonitrile
CID 161293768
2,5-dithiophen-2-ylthiophene;ethane
CID 169103820
2-fluoro-4-(5-thiophen-2-ylthiophen-2-yl)benzonitrile
CID 155806543
2-[9-(dicyanomethylidene)-2-(5-thiophen-2-ylthiophen-2-yl)benzo[f][1]benzothiol-4-ylidene]propanedinitrile
CID 177415511
ethane;thiophene-2-carbonitrile
CID 143604797
tris(5-thiophen-2-ylthiophen-2-yl)phosphane
CID 101444105
5-[5-(dimethylamino)thiophen-2-yl]thiophene-2-carbonitrile
CID 10082783
5-(5-cyanothiophen-3-yl)thiophene-2-carbonitrile
CID 171537965
5-(furan-2-yl)thiophene-2-carbonitrile
CID 57377058
2,5-dithiophen-2-ylbenzene-1,4-dicarbonitrile
CID 3632903
5-[4-(trifluoromethyl)phenyl]thiophene-2-carbonitrile
CID 11242212

Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-ylthiophene-2-carbonitrile?
The IUPAC name of 5-thiophen-2-ylthiophene-2-carbonitrile (CID 2739839) is 5-thiophen-2-ylthiophene-2-carbonitrile.
What is the SMILES notation for 5-thiophen-2-ylthiophene-2-carbonitrile?
The canonical SMILES for 5-thiophen-2-ylthiophene-2-carbonitrile is N#Cc1ccc(-c2cccs2)s1.
What is the InChIKey of 5-thiophen-2-ylthiophene-2-carbonitrile?
The InChIKey is ANARYBGZNUMARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5NS2/c10-6-7-3-4-9(12-7)8-2-1-5-11-8/h1-5H.
What are the key properties of 5-thiophen-2-ylthiophene-2-carbonitrile?
5-thiophen-2-ylthiophene-2-carbonitrile has a molecular weight of 191.28 g/mol, XLogP of 3.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-ylthiophene-2-carbonitrile is sourced from PubChem (CID 2739839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).