2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide

C12H11N5OS — CID 62800301

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide
SMILESNc1nc(CC(=O)Nc2ccc3cn[nH]c3c2)cs1
InChIInChI=1S/C12H11N5OS/c13-12-16-9(6-19-12)4-11(18)15-8-2-1-7-5-14-17-10(7)3-8/h1-3,5-6H,4H2,(H2,13,16)(H,14,17)(H,15,18)
InChIKeyOHUPVWLFFXSJBC-UHFFFAOYSA-N
MW273.32 g/mol
LogP1.78
Rot. Bonds3

About 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide

2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide (PubChem CID 62800301) has the molecular formula C12H11N5OS and a molecular weight of 273.32 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide
PubChem CID62800301
Molecular FormulaC12H11N5OS
Molecular Weight273.32 g/mol
Exact Mass273.07
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide
SMILESNc1nc(CC(=O)Nc2ccc3cn[nH]c3c2)cs1
InChIInChI=1S/C12H11N5OS/c13-12-16-9(6-19-12)4-11(18)15-8-2-1-7-5-14-17-10(7)3-8/h1-3,5-6H,4H2,(H2,13,16)(H,14,17)(H,15,18)
InChIKeyOHUPVWLFFXSJBC-UHFFFAOYSA-N
XLogP1.78
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminophenyl)-N-(1H-indazol-6-yl)acetamide
CID 43710788
2-(2-amino-1,3-thiazol-4-yl)-N-pyridin-4-ylacetamide
CID 62795383
5-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-1H-pyrazole-4-carboxylic acid
CID 110483663
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-(1H-indazol-5-yl)acetamide
CID 110450636
2-(2-amino-1,3-thiazol-4-yl)-N-(4-iodophenyl)acetamide
CID 12686359
2-(2-amino-1,3-thiazol-4-yl)-N-(1-benzothiophen-5-yl)acetamide
CID 62798357
N-(1H-indazol-6-yl)-2-(1H-pyrazol-5-yl)acetamide
CID 84575634
2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide
CID 66351961
2-(2-amino-1,3-thiazol-4-yl)-N-(3-chlorophenyl)acetamide
CID 55120912
4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-2-chlorobenzoic acid
CID 62800000
2-[4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]phenyl]acetamide
CID 62798897
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]benzoic acid
CID 55120222

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide (CID 62800301) is 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide is Nc1nc(CC(=O)Nc2ccc3cn[nH]c3c2)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide?
The InChIKey is OHUPVWLFFXSJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5OS/c13-12-16-9(6-19-12)4-11(18)15-8-2-1-7-5-14-17-10(7)3-8/h1-3,5-6H,4H2,(H2,13,16)(H,14,17)(H,15,18).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide has a molecular weight of 273.32 g/mol, XLogP of 1.78, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-(1H-indazol-6-yl)acetamide is sourced from PubChem (CID 62800301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).