2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide

C14H13N5OS — CID 86998526

IUPAC2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide
SMILESCc1nc(CC(=O)Nc2ccc(-n3nccn3)cc2)cs1
InChIInChI=1S/C14H13N5OS/c1-10-17-12(9-21-10)8-14(20)18-11-2-4-13(5-3-11)19-15-6-7-16-19/h2-7,9H,8H2,1H3,(H,18,20)
InChIKeyZUAOLEUTJXASAD-UHFFFAOYSA-N
MW299.36 g/mol
LogP2.21
Rot. Bonds4

About 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide

2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide (PubChem CID 86998526) has the molecular formula C14H13N5OS and a molecular weight of 299.36 g/mol. Its IUPAC name is 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide
PubChem CID86998526
Molecular FormulaC14H13N5OS
Molecular Weight299.36 g/mol
Exact Mass299.08
IUPAC Name2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide
SMILESCc1nc(CC(=O)Nc2ccc(-n3nccn3)cc2)cs1
InChIInChI=1S/C14H13N5OS/c1-10-17-12(9-21-10)8-14(20)18-11-2-4-13(5-3-11)19-15-6-7-16-19/h2-7,9H,8H2,1H3,(H,18,20)
InChIKeyZUAOLEUTJXASAD-UHFFFAOYSA-N
XLogP2.21
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-aminophenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110483632
N-(2-methyl-4-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110463240
N-[2-(4-chlorophenyl)pyrazol-3-yl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 71993391
2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(propylsulfamoyl)phenyl]acetamide
CID 134063109
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 37038934
N-[3-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]phenyl]butanamide
CID 87026123
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 29455186
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 38925497
N-(1-methylimidazol-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110473002
N-(4-fluorophenyl)-2-[(2-methyl-1,3-thiazol-4-yl)methylamino]acetamide
CID 61283431
6-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]pyridine-2-carboxylic acid
CID 63642384
N-(2,6-difluorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 110463255

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide?
The IUPAC name of 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide (CID 86998526) is 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide is Cc1nc(CC(=O)Nc2ccc(-n3nccn3)cc2)cs1.
What is the InChIKey of 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide?
The InChIKey is ZUAOLEUTJXASAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5OS/c1-10-17-12(9-21-10)8-14(20)18-11-2-4-13(5-3-11)19-15-6-7-16-19/h2-7,9H,8H2,1H3,(H,18,20).
What are the key properties of 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide?
2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide has a molecular weight of 299.36 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1,3-thiazol-4-yl)-N-[4-(triazol-2-yl)phenyl]acetamide is sourced from PubChem (CID 86998526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).