N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide

C15H12N4OS — CID 62905439

IUPACN-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide
SMILESCc1sc(NC(=O)c2ccc3cn[nH]c3c2)c(C#N)c1C
InChIInChI=1S/C15H12N4OS/c1-8-9(2)21-15(12(8)6-16)18-14(20)10-3-4-11-7-17-19-13(11)5-10/h3-5,7H,1-2H3,(H,17,19)(H,18,20)
InChIKeyBHCDYHVAYAFNOZ-UHFFFAOYSA-N
MW296.36 g/mol
LogP3.37
Rot. Bonds2

About N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide

N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide (PubChem CID 62905439) has the molecular formula C15H12N4OS and a molecular weight of 296.36 g/mol. Its IUPAC name is N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide
PubChem CID62905439
Molecular FormulaC15H12N4OS
Molecular Weight296.36 g/mol
Exact Mass296.07
IUPAC NameN-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide
SMILESCc1sc(NC(=O)c2ccc3cn[nH]c3c2)c(C#N)c1C
InChIInChI=1S/C15H12N4OS/c1-8-9(2)21-15(12(8)6-16)18-14(20)10-3-4-11-7-17-19-13(11)5-10/h3-5,7H,1-2H3,(H,17,19)(H,18,20)
InChIKeyBHCDYHVAYAFNOZ-UHFFFAOYSA-N
XLogP3.37
TPSA81.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-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-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide (CID 62905439) is N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide is Cc1sc(NC(=O)c2ccc3cn[nH]c3c2)c(C#N)c1C.
What is the InChIKey of N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide?
The InChIKey is BHCDYHVAYAFNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4OS/c1-8-9(2)21-15(12(8)6-16)18-14(20)10-3-4-11-7-17-19-13(11)5-10/h3-5,7H,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide?
N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide has a molecular weight of 296.36 g/mol, XLogP of 3.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 62905439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).