2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide

C11H17N3O4S — CID 43310749

IUPAC2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide
SMILESCOc1cc(N)ccc1S(=O)(=O)NCC(=O)N(C)C
InChIInChI=1S/C11H17N3O4S/c1-14(2)11(15)7-13-19(16,17)10-5-4-8(12)6-9(10)18-3/h4-6,13H,7,12H2,1-3H3
InChIKeyHYUYBOCNQGNMMR-UHFFFAOYSA-N
MW287.34 g/mol
LogP-0.36
Rot. Bonds5

About 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide

2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide (PubChem CID 43310749) has the molecular formula C11H17N3O4S and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide
PubChem CID43310749
Molecular FormulaC11H17N3O4S
Molecular Weight287.34 g/mol
Exact Mass287.09
IUPAC Name2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide
SMILESCOc1cc(N)ccc1S(=O)(=O)NCC(=O)N(C)C
InChIInChI=1S/C11H17N3O4S/c1-14(2)11(15)7-13-19(16,17)10-5-4-8(12)6-9(10)18-3/h4-6,13H,7,12H2,1-3H3
InChIKeyHYUYBOCNQGNMMR-UHFFFAOYSA-N
XLogP-0.36
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N-ethylacetamide
CID 43566769
4-amino-N-(4-hydroxybutyl)-2-methoxybenzenesulfonamide
CID 106840223
methyl 3-[(4-amino-2-methoxyphenyl)sulfonylamino]propanoate
CID 43665942
4-amino-N-[3-(diethylamino)propyl]-2-methoxybenzenesulfonamide
CID 3046698
4-amino-2-methoxy-N-(3-methylbutyl)benzenesulfonamide
CID 43258356
4-amino-N-(2,2-difluoroethyl)-2-methoxybenzenesulfonamide
CID 113303531
methyl 2-[(4-amino-2-methylphenyl)sulfonylamino]acetate
CID 43257168
2-(4-amino-2-methoxyphenyl)sulfonyl-N-methyl-N-propan-2-ylacetamide
CID 81206794
4-amino-2-methoxy-N-(2-propan-2-yloxyethyl)benzenesulfonamide
CID 104758400
2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-methyl-N-phenylacetamide
CID 112996322
4-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxybenzenesulfonamide
CID 66179699
4-amino-N-(2-cyclopropyl-2-hydroxyethyl)-2-methoxybenzenesulfonamide
CID 63294130

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide (CID 43310749) is 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide is COc1cc(N)ccc1S(=O)(=O)NCC(=O)N(C)C.
What is the InChIKey of 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide?
The InChIKey is HYUYBOCNQGNMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4S/c1-14(2)11(15)7-13-19(16,17)10-5-4-8(12)6-9(10)18-3/h4-6,13H,7,12H2,1-3H3.
What are the key properties of 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide?
2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide has a molecular weight of 287.34 g/mol, XLogP of -0.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-2-methoxyphenyl)sulfonylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 43310749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).