2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid

C6H8N2O2S — CID 24710032

IUPAC2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid
SMILESCc1csc(NCC(=O)O)n1
InChIInChI=1S/C6H8N2O2S/c1-4-3-11-6(8-4)7-2-5(9)10/h3H,2H2,1H3,(H,7,8)(H,9,10)
InChIKeySUGCYSKUDKOKDX-UHFFFAOYSA-N
MW172.21 g/mol
LogP0.95
Rot. Bonds3

About 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid

2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid (PubChem CID 24710032) has the molecular formula C6H8N2O2S and a molecular weight of 172.21 g/mol. Its IUPAC name is 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid
PubChem CID24710032
Molecular FormulaC6H8N2O2S
Molecular Weight172.21 g/mol
Exact Mass172.03
IUPAC Name2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid
SMILESCc1csc(NCC(=O)O)n1
InChIInChI=1S/C6H8N2O2S/c1-4-3-11-6(8-4)7-2-5(9)10/h3H,2H2,1H3,(H,7,8)(H,9,10)
InChIKeySUGCYSKUDKOKDX-UHFFFAOYSA-N
XLogP0.95
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.21
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid 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

2-{[(2-Amino-1,3-thiazol-4-yl)methyl]sulfanyl}acetic acid
CID 38996181
2-(Ethylamino)-1,3-thiazole-4-carboxylic acid
CID 22250124
2-(Methylamino)-1,3-thiazole-4-carboxylic acid
CID 45032346
2-(Allylamino)thiazole-4-carboxylic acid
CID 2090946
2-(Isopropylamino)-1,3-thiazole-4-carboxylic acid
CID 11953490
2-((4-Methyl-1,3-thiazol-2-yl)amino)propanoic acid
CID 43468858
Sodium 2-(methylamino)-1,3-thiazole-4-carboxylate
CID 167735249
2-[Propyl-[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetic acid
CID 120964964
2-(Isobutylamino)-1,3-thiazole-4-carboxylic acid
CID 5019946
2-[(4-Methyl-1,3-thiazol-2-yl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79257830
2-[[2-[(4-Methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258183
2-[(4-Methyl-1,3-thiazol-2-yl)carbamoyl-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79265802

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid?
The IUPAC name of 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid (CID 24710032) is 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid.
What is the SMILES notation for 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid?
The canonical SMILES for 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid is Cc1csc(NCC(=O)O)n1.
What is the InChIKey of 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid?
The InChIKey is SUGCYSKUDKOKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2S/c1-4-3-11-6(8-4)7-2-5(9)10/h3H,2H2,1H3,(H,7,8)(H,9,10).
What are the key properties of 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid?
2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid has a molecular weight of 172.21 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methyl-1,3-thiazol-2-yl)amino]acetic acid is sourced from PubChem (CID 24710032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).