4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide

C13H15N3O3S — CID 86046967

IUPAC4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
SMILESCOCCOc1cc(N)ccc1C(=O)Nc1nccs1
InChIInChI=1S/C13H15N3O3S/c1-18-5-6-19-11-8-9(14)2-3-10(11)12(17)16-13-15-4-7-20-13/h2-4,7-8H,5-6,14H2,1H3,(H,15,16,17)
InChIKeyUKZIGVLYHYNORP-UHFFFAOYSA-N
MW293.35 g/mol
LogP2.00
Rot. Bonds6

About 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide

4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 86046967) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
PubChem CID86046967
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
SMILESCOCCOc1cc(N)ccc1C(=O)Nc1nccs1
InChIInChI=1S/C13H15N3O3S/c1-18-5-6-19-11-8-9(14)2-3-10(11)12(17)16-13-15-4-7-20-13/h2-4,7-8H,5-6,14H2,1H3,(H,15,16,17)
InChIKeyUKZIGVLYHYNORP-UHFFFAOYSA-N
XLogP2.00
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-(2-methoxyethoxy)-1-methyl-6-oxo-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 132532959
5-bromo-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 15943059
4-nitro-2-propoxy-N-(1,3-thiazol-2-yl)benzamide
CID 86046963
3-bromo-4-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 15943256
4-butoxy-3-methoxy-N-(1,3-thiazol-2-yl)benzamide
CID 2666591
ethyl 4-amino-2-(2-methoxyethoxy)benzoate
CID 106955360
4-amino-2-[2-(2-methoxyethoxy)ethoxy]benzoic acid
CID 104564131
6-amino-N-(1,3-thiazol-2-yl)-1H-indole-3-carboxamide
CID 61089769
2-hydroxy-4,5-dimethoxy-N-(1,3-thiazol-2-yl)benzamide
CID 141049066
3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide
CID 2083346
2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide
CID 953286
4-amino-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzoyl chloride
CID 102159784

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide (CID 86046967) is 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide is COCCOc1cc(N)ccc1C(=O)Nc1nccs1.
What is the InChIKey of 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is UKZIGVLYHYNORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-18-5-6-19-11-8-9(14)2-3-10(11)12(17)16-13-15-4-7-20-13/h2-4,7-8H,5-6,14H2,1H3,(H,15,16,17).
What are the key properties of 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide?
4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 293.35 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 86046967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).