2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide

C12H11N5OS — CID 55115347

IUPAC2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C12H11N5OS/c1-6-10(19-12(13)15-6)11(18)16-8-3-2-7-5-14-17-9(7)4-8/h2-5H,1H3,(H2,13,15)(H,14,17)(H,16,18)
InChIKeyNSYVHXQOUJHVQA-UHFFFAOYSA-N
MW273.32 g/mol
LogP2.16
Rot. Bonds2

About 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide

2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 55115347) has the molecular formula C12H11N5OS and a molecular weight of 273.32 g/mol. Its IUPAC name is 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID55115347
Molecular FormulaC12H11N5OS
Molecular Weight273.32 g/mol
Exact Mass273.07
IUPAC Name2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C12H11N5OS/c1-6-10(19-12(13)15-6)11(18)16-8-3-2-7-5-14-17-9(7)4-8/h2-5H,1H3,(H2,13,15)(H,14,17)(H,16,18)
InChIKeyNSYVHXQOUJHVQA-UHFFFAOYSA-N
XLogP2.16
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-4-methyl-N-naphthalen-2-yl-1,3-thiazole-5-carboxamide
CID 62794262
N-(1H-indazol-6-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 110684914
N-(1H-indazol-6-yl)-3,5-dimethylbenzamide
CID 36560760
2-amino-N-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 62793569
N-(5-acetamido-2-methylphenyl)-2-amino-4-methyl-1,3-thiazole-5-carboxamide
CID 62794259
2-amino-N-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 62793227
5-bromo-N-(1H-indazol-6-yl)-4-methylthiophene-2-carboxamide
CID 79964870
2-amino-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
CID 735558
N-(1H-indazol-6-yl)-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 110692000
2-amino-N-(4-tert-butylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 62794412
4-bromo-N-(1H-indazol-6-yl)-3-methylbenzamide
CID 115769574
2-amino-4-methyl-N-[4-(methylcarbamoyl)phenyl]-1,3-thiazole-5-carboxamide
CID 62792729

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide (CID 55115347) is 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide is Cc1nc(N)sc1C(=O)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is NSYVHXQOUJHVQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5OS/c1-6-10(19-12(13)15-6)11(18)16-8-3-2-7-5-14-17-9(7)4-8/h2-5H,1H3,(H2,13,15)(H,14,17)(H,16,18).
What are the key properties of 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide?
2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 273.32 g/mol, XLogP of 2.16, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1H-indazol-6-yl)-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 55115347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).