2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide

C10H15N3O3S — CID 43452561

IUPAC2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide
SMILESCNC(=O)CNS(=O)(=O)c1c(C)cccc1N
InChIInChI=1S/C10H15N3O3S/c1-7-4-3-5-8(11)10(7)17(15,16)13-6-9(14)12-2/h3-5,13H,6,11H2,1-2H3,(H,12,14)
InChIKeyUZMMGNUHQMGTHT-UHFFFAOYSA-N
MW257.31 g/mol
LogP-0.40
Rot. Bonds4

About 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide

2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide (PubChem CID 43452561) has the molecular formula C10H15N3O3S and a molecular weight of 257.31 g/mol. Its IUPAC name is 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide
PubChem CID43452561
Molecular FormulaC10H15N3O3S
Molecular Weight257.31 g/mol
Exact Mass257.08
IUPAC Name2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide
SMILESCNC(=O)CNS(=O)(=O)c1c(C)cccc1N
InChIInChI=1S/C10H15N3O3S/c1-7-4-3-5-8(11)10(7)17(15,16)13-6-9(14)12-2/h3-5,13H,6,11H2,1-2H3,(H,12,14)
InChIKeyUZMMGNUHQMGTHT-UHFFFAOYSA-N
XLogP-0.40
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide 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-amino-6-methyl-N-(2-methylprop-2-enyl)benzenesulfonamide
CID 114615118
2-amino-6-methyl-N-propylbenzenesulfonamide
CID 43452324
2-amino-N-(6-hydroxyhexyl)-6-methylbenzenesulfonamide
CID 107843459
2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylpropanamide
CID 54950915
2-amino-6-methyl-N-prop-2-ynylbenzenesulfonamide
CID 61112321
2-amino-N-(2,3-dihydroxy-2-methylpropyl)-6-methylbenzenesulfonamide
CID 66168995
2-amino-N-hexyl-6-methylbenzenesulfonamide
CID 61110838
3-[(2-amino-6-methylphenyl)sulfonylamino]-N,N-diethylpropanamide
CID 61125157
2-amino-N-[(4-ethylphenyl)methyl]-6-methylbenzenesulfonamide
CID 106899187
2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N-methylacetamide
CID 43310321
2-amino-N-(2-cyclopropyl-2-hydroxyethyl)-6-methylbenzenesulfonamide
CID 63294178
3-[(2-amino-3,6-dimethylphenyl)sulfonylamino]-N-methylpropanamide
CID 103171406

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide?
The IUPAC name of 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide (CID 43452561) is 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide?
The canonical SMILES for 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide is CNC(=O)CNS(=O)(=O)c1c(C)cccc1N.
What is the InChIKey of 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide?
The InChIKey is UZMMGNUHQMGTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c1-7-4-3-5-8(11)10(7)17(15,16)13-6-9(14)12-2/h3-5,13H,6,11H2,1-2H3,(H,12,14).
What are the key properties of 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide?
2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide has a molecular weight of 257.31 g/mol, XLogP of -0.40, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-6-methylphenyl)sulfonylamino]-N-methylacetamide is sourced from PubChem (CID 43452561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).