N-(2-methylindazol-6-yl)thiophene-2-carboxamide

C13H11N3OS — CID 861789

IUPACN-(2-methylindazol-6-yl)thiophene-2-carboxamide
SMILESCn1cc2ccc(NC(=O)c3cccs3)cc2n1
InChIInChI=1S/C13H11N3OS/c1-16-8-9-4-5-10(7-11(9)15-16)14-13(17)12-3-2-6-18-12/h2-8H,1H3,(H,14,17)
InChIKeyMLIFKFDECWMHCD-UHFFFAOYSA-N
MW257.32 g/mol
LogP2.89
Rot. Bonds2

About N-(2-methylindazol-6-yl)thiophene-2-carboxamide

N-(2-methylindazol-6-yl)thiophene-2-carboxamide (PubChem CID 861789) has the molecular formula C13H11N3OS and a molecular weight of 257.32 g/mol. Its IUPAC name is N-(2-methylindazol-6-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylindazol-6-yl)thiophene-2-carboxamide
PubChem CID861789
Molecular FormulaC13H11N3OS
Molecular Weight257.32 g/mol
Exact Mass257.06
IUPAC NameN-(2-methylindazol-6-yl)thiophene-2-carboxamide
SMILESCn1cc2ccc(NC(=O)c3cccs3)cc2n1
InChIInChI=1S/C13H11N3OS/c1-16-8-9-4-5-10(7-11(9)15-16)14-13(17)12-3-2-6-18-12/h2-8H,1H3,(H,14,17)
InChIKeyMLIFKFDECWMHCD-UHFFFAOYSA-N
XLogP2.89
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.32
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(3-methylpyrazol-1-yl)phenyl]thiophene-2-carboxamide
CID 5298288
phenyl[3-(2-thienyl)-1H-pyrazol-1-yl]methanone
CID 2814851
N-[1-(2,4-difluorophenyl)-4,5,6,7-tetrahydro-1H-indazol-4-yl]-3-thiophenecarboxamide
CID 45184368
N-[3-(1H-pyrazol-1-ylmethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 1245434
N'-[(3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-2-thiophenecarbohydrazide
CID 9583897
N'-(1H-indol-3-ylmethylene)-2-thiophenecarbohydrazide
CID 135520251
5-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1H-indol-6-yl)thiophene-2-carboxamide
CID 164614300
5-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(4-pyridin-3-ylphenyl)thiophene-2-carboxamide
CID 164617763
5-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(4-fluoro-2-methylphenyl)thiophene-2-carboxamide
CID 164619960
N-[1-(2,4-difluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-2-thiophenecarboxamide
CID 46916321
5-(1,5-dimethylindazol-6-yl)-N-(2-fluorophenyl)thiophene-2-carboxamide
CID 56848040
N-(2,6-difluorophenyl)-5-(2,5-dimethylindazol-6-yl)thiophene-2-carboxamide
CID 56848088

Frequently Asked Questions

What is the IUPAC name of N-(2-methylindazol-6-yl)thiophene-2-carboxamide?
The IUPAC name of N-(2-methylindazol-6-yl)thiophene-2-carboxamide (CID 861789) is N-(2-methylindazol-6-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-methylindazol-6-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-methylindazol-6-yl)thiophene-2-carboxamide is Cn1cc2ccc(NC(=O)c3cccs3)cc2n1.
What is the InChIKey of N-(2-methylindazol-6-yl)thiophene-2-carboxamide?
The InChIKey is MLIFKFDECWMHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3OS/c1-16-8-9-4-5-10(7-11(9)15-16)14-13(17)12-3-2-6-18-12/h2-8H,1H3,(H,14,17).
What are the key properties of N-(2-methylindazol-6-yl)thiophene-2-carboxamide?
N-(2-methylindazol-6-yl)thiophene-2-carboxamide has a molecular weight of 257.32 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylindazol-6-yl)thiophene-2-carboxamide is sourced from PubChem (CID 861789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).