5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide

C17H16N6OS — CID 139448036

IUPAC5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide
SMILESCc1cnc(NC(=O)c2n[nH]c3ccc(-c4cnc(C)n4C)cc23)s1
InChIInChI=1S/C17H16N6OS/c1-9-7-19-17(25-9)20-16(24)15-12-6-11(4-5-13(12)21-22-15)14-8-18-10(2)23(14)3/h4-8H,1-3H3,(H,21,22)(H,19,20,24)
InChIKeyJIAZSERXZIKLHU-UHFFFAOYSA-N
MW352.42 g/mol
LogP3.29
Rot. Bonds3

About 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide

5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide (PubChem CID 139448036) has the molecular formula C17H16N6OS and a molecular weight of 352.42 g/mol. Its IUPAC name is 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide
PubChem CID139448036
Molecular FormulaC17H16N6OS
Molecular Weight352.42 g/mol
Exact Mass352.11
IUPAC Name5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide
SMILESCc1cnc(NC(=O)c2n[nH]c3ccc(-c4cnc(C)n4C)cc23)s1
InChIInChI=1S/C17H16N6OS/c1-9-7-19-17(25-9)20-16(24)15-12-6-11(4-5-13(12)21-22-15)14-8-18-10(2)23(14)3/h4-8H,1-3H3,(H,21,22)(H,19,20,24)
InChIKeyJIAZSERXZIKLHU-UHFFFAOYSA-N
XLogP3.29
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2S)-3,3-difluorobutan-2-yl]-5-(2,3-dimethylimidazol-4-yl)-1H-indazole-3-carboxamide
CID 158874366
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(5-prop-1-en-2-ylthiophen-2-yl)-1H-imidazo[4,5-c]pyridine
CID 145034360
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine
CID 137283181
3-amino-N-(5-methyl-1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 64524009
formic acid;[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-[5-(5-methyl-1,3-thiazol-2-yl)-1H-indazol-3-yl]methanone
CID 69489262
N-[5-(1-hydroxycyclobutyl)-1,3-thiazol-2-yl]-5-methoxy-1H-indazole-3-carboxamide
CID 166380438
5-amino-2,4-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 102704840
formic acid;N-(2-methyl-2-azabicyclo[2.2.1]heptan-5-yl)-6-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide
CID 161043962
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine
CID 137114172
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(5-fluorothiophen-2-yl)-1H-pyrrolo[2,3-c]pyridine
CID 137087576
5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 89459134
5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 118382000

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide (CID 139448036) is 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide is Cc1cnc(NC(=O)c2n[nH]c3ccc(-c4cnc(C)n4C)cc23)s1.
What is the InChIKey of 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide?
The InChIKey is JIAZSERXZIKLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6OS/c1-9-7-19-17(25-9)20-16(24)15-12-6-11(4-5-13(12)21-22-15)14-8-18-10(2)23(14)3/h4-8H,1-3H3,(H,21,22)(H,19,20,24).
What are the key properties of 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide?
5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide has a molecular weight of 352.42 g/mol, XLogP of 3.29, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dimethylimidazol-4-yl)-N-(5-methyl-1,3-thiazol-2-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 139448036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).