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

C7H11N3O2S — CID 82171902

IUPAC2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide
SMILESCOCCNC(=O)c1cnc(N)s1
InChIInChI=1S/C7H11N3O2S/c1-12-3-2-9-6(11)5-4-10-7(8)13-5/h4H,2-3H2,1H3,(H2,8,10)(H,9,11)
InChIKeyRCKYJTKHGNTPOZ-UHFFFAOYSA-N
MW201.25 g/mol
LogP0.10
Rot. Bonds4

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

2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide (PubChem CID 82171902) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide
PubChem CID82171902
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC Name2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide
SMILESCOCCNC(=O)c1cnc(N)s1
InChIInChI=1S/C7H11N3O2S/c1-12-3-2-9-6(11)5-4-10-7(8)13-5/h4H,2-3H2,1H3,(H2,8,10)(H,9,11)
InChIKeyRCKYJTKHGNTPOZ-UHFFFAOYSA-N
XLogP0.10
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-chlorophenyl)-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide
CID 49371122
2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-sulfonamide
CID 91812348
1-(2-amino-1,3-thiazol-5-yl)ethanone;hydrobromide
CID 13130947
methyl 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-1,3-thiazole-5-carboxylate
CID 113405769
3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104740778
2-amino-N-(2-methoxyethyl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 39071451
2-amino-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-thiazole-5-carboxamide
CID 122557442
4-[[(2-amino-1,3-thiazole-5-carbonyl)amino]methyl]piperidine-1-carboxylic acid
CID 90895817
2-amino-N-(2-ethylphenyl)-1,3-thiazole-5-carboxamide
CID 141271026
1-amino-N-(2-methoxyethyl)isoquinoline-4-carboxamide
CID 106770080
2-amino-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide
CID 82171914
4-amino-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 81235993

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide (CID 82171902) is 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide is COCCNC(=O)c1cnc(N)s1.
What is the InChIKey of 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide?
The InChIKey is RCKYJTKHGNTPOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-12-3-2-9-6(11)5-4-10-7(8)13-5/h4H,2-3H2,1H3,(H2,8,10)(H,9,11).
What are the key properties of 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide?
2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide has a molecular weight of 201.25 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 82171902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).