2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane

C7H12N2O3S — CID 126619372

IUPAC2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane
SMILESCOC.Nc1ncc(CC(=O)O)s1
InChIInChI=1S/C5H6N2O2S.C2H6O/c6-5-7-2-3(10-5)1-4(8)9;1-3-2/h2H,1H2,(H2,6,7)(H,8,9);1-2H3
InChIKeyQTHOKBCNSUZCPB-UHFFFAOYSA-N
MW204.25 g/mol
LogP0.62
Rot. Bonds2

About 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane

2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane (PubChem CID 126619372) has the molecular formula C7H12N2O3S and a molecular weight of 204.25 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane
PubChem CID126619372
Molecular FormulaC7H12N2O3S
Molecular Weight204.25 g/mol
Exact Mass204.06
IUPAC Name2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane
SMILESCOC.Nc1ncc(CC(=O)O)s1
InChIInChI=1S/C5H6N2O2S.C2H6O/c6-5-7-2-3(10-5)1-4(8)9;1-3-2/h2H,1H2,(H2,6,7)(H,8,9);1-2H3
InChIKeyQTHOKBCNSUZCPB-UHFFFAOYSA-N
XLogP0.62
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane 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-5-yl)-N-methylacetamide
CID 43840159
tert-butyl 2-(2-amino-1,3-thiazol-5-yl)acetate
CID 133058846
2-(2-bromo-1,3-thiazol-5-yl)acetic acid
CID 71721405
methyl 2-[(2-amino-1,3-thiazol-5-yl)methylsulfanyl]acetate
CID 79774327
2-[2-(3,5-dimethoxyphenyl)-1,3-thiazol-5-yl]acetic acid
CID 82369371
5-(2-methoxyethoxymethyl)-1,3-thiazol-2-amine
CID 79775147
2-[2-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-thiazol-5-yl]acetic acid
CID 71744301
diethyl 2-[(2-amino-1,3-thiazol-5-yl)methyl]propanedioate
CID 54568864
2-[2-[(2,6-dimethylphenoxy)methyl]-1,3-thiazol-5-yl]acetic acid
CID 82422966
2-[4-[(2-amino-1,3-thiazol-5-yl)oxy]phenyl]acetic acid
CID 140557880
5-[[2-methoxyethyl(methyl)amino]methyl]-1,3-thiazol-2-amine
CID 79771856
5-ethyl-1,3-thiazol-2-amine;thiourea
CID 160637365

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane?
The IUPAC name of 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane (CID 126619372) is 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane?
The canonical SMILES for 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane is COC.Nc1ncc(CC(=O)O)s1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane?
The InChIKey is QTHOKBCNSUZCPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2S.C2H6O/c6-5-7-2-3(10-5)1-4(8)9;1-3-2/h2H,1H2,(H2,6,7)(H,8,9);1-2H3.
What are the key properties of 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane?
2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane has a molecular weight of 204.25 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-5-yl)acetic acid;methoxymethane is sourced from PubChem (CID 126619372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).