N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide

C16H12N2O2S2 — CID 573445

IUPACN-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1cccs1
InChIInChI=1S/C16H12N2O2S2/c19-15(13-3-1-9-21-13)17-11-5-7-12(8-6-11)18-16(20)14-4-2-10-22-14/h1-10H,(H,17,19)(H,18,20)
InChIKeyMDPSKKPTMJIIKO-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.31
Rot. Bonds4

About N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide

N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide (PubChem CID 573445) has the molecular formula C16H12N2O2S2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide
PubChem CID573445
Molecular FormulaC16H12N2O2S2
Molecular Weight328.42 g/mol
Exact Mass328.03
IUPAC NameN-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1cccs1
InChIInChI=1S/C16H12N2O2S2/c19-15(13-3-1-9-21-13)17-11-5-7-12(8-6-11)18-16(20)14-4-2-10-22-14/h1-10H,(H,17,19)(H,18,20)
InChIKeyMDPSKKPTMJIIKO-UHFFFAOYSA-N
XLogP4.31
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-(thiophene-2-carbonylamino)phenyl]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-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide (CID 573445) is N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide is O=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1cccs1.
What is the InChIKey of N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide?
The InChIKey is MDPSKKPTMJIIKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2S2/c19-15(13-3-1-9-21-13)17-11-5-7-12(8-6-11)18-16(20)14-4-2-10-22-14/h1-10H,(H,17,19)(H,18,20).
What are the key properties of N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide?
N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 4.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 573445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).