N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide

C6H7N3O3S — CID 103901233

IUPACN-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide
SMILESNC(=O)CONC(=O)c1cncs1
InChIInChI=1S/C6H7N3O3S/c7-5(10)2-12-9-6(11)4-1-8-3-13-4/h1,3H,2H2,(H2,7,10)(H,9,11)
InChIKeyHYTLZEDBGVHFPT-UHFFFAOYSA-N
MW201.21 g/mol
LogP-0.71
Rot. Bonds4

About N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide

N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide (PubChem CID 103901233) has the molecular formula C6H7N3O3S and a molecular weight of 201.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide
PubChem CID103901233
Molecular FormulaC6H7N3O3S
Molecular Weight201.21 g/mol
Exact Mass201.02
IUPAC NameN-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide
SMILESNC(=O)CONC(=O)c1cncs1
InChIInChI=1S/C6H7N3O3S/c7-5(10)2-12-9-6(11)4-1-8-3-13-4/h1,3H,2H2,(H2,7,10)(H,9,11)
InChIKeyHYTLZEDBGVHFPT-UHFFFAOYSA-N
XLogP-0.71
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.21
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide (CID 103901233) is N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide is NC(=O)CONC(=O)c1cncs1.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide?
The InChIKey is HYTLZEDBGVHFPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O3S/c7-5(10)2-12-9-6(11)4-1-8-3-13-4/h1,3H,2H2,(H2,7,10)(H,9,11).
What are the key properties of N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide?
N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide has a molecular weight of 201.21 g/mol, XLogP of -0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 103901233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).