2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide

C8H10Cl2N4O5S2 — CID 10833411

IUPAC2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide
SMILESNCC(=O)Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(Cl)c1Cl
InChIInChI=1S/C8H10Cl2N4O5S2/c9-6-3(20(12,16)17)1-4(21(13,18)19)8(7(6)10)14-5(15)2-11/h1H,2,11H2,(H,14,15)(H2,12,16,17)(H2,13,18,19)
InChIKeyIVDRQODMKDJZCG-UHFFFAOYSA-N
MW377.23 g/mol
LogP-0.81
Rot. Bonds4

About 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide

2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide (PubChem CID 10833411) has the molecular formula C8H10Cl2N4O5S2 and a molecular weight of 377.23 g/mol. Its IUPAC name is 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide
PubChem CID10833411
Molecular FormulaC8H10Cl2N4O5S2
Molecular Weight377.23 g/mol
Exact Mass375.95
IUPAC Name2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide
SMILESNCC(=O)Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(Cl)c1Cl
InChIInChI=1S/C8H10Cl2N4O5S2/c9-6-3(20(12,16)17)1-4(21(13,18)19)8(7(6)10)14-5(15)2-11/h1H,2,11H2,(H,14,15)(H2,12,16,17)(H2,13,18,19)
InChIKeyIVDRQODMKDJZCG-UHFFFAOYSA-N
XLogP-0.81
TPSA175.44 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.23
LogP ≤ 5-0.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)propanamide
CID 10834283
(2S,3R)-3-[(2,3-dichloro-4,6-disulfamoylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 101113201
4-amino-5,6-dichlorobenzene-1,3-disulfonamide
CID 2781602
4-[(2-aminoacetyl)amino]-3,5-dichlorobenzoic acid
CID 82830709
N-(2,6-dichloro-3-methyl-4-sulfamoylphenyl)-3,3-dimethylbutanamide
CID 43246574
N-(2,6-dichloro-3-methyl-4-sulfamoylphenyl)pentanamide
CID 43246587
2-amino-N-[2-(2-chloro-5-sulfamoylanilino)-2-oxoethyl]acetamide
CID 60849966
2-amino-N-(2,3,5,6-tetramethylphenyl)acetamide
CID 82492252
N-(5-chloro-2,4-disulfamoylphenyl)-2-cyanoacetamide
CID 168520102
4,5-dichloro-6-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonylamino)benzene-1,3-disulfonamide
CID 10817418
4-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3,5-dichlorobenzoic acid
CID 82830278
N-(2,6-dichloro-4-sulfamoylphenyl)-3,3,3-trifluoropropanamide
CID 43246826

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide?
The IUPAC name of 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide (CID 10833411) is 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide is NCC(=O)Nc1c(S(N)(=O)=O)cc(S(N)(=O)=O)c(Cl)c1Cl.
What is the InChIKey of 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide?
The InChIKey is IVDRQODMKDJZCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10Cl2N4O5S2/c9-6-3(20(12,16)17)1-4(21(13,18)19)8(7(6)10)14-5(15)2-11/h1H,2,11H2,(H,14,15)(H2,12,16,17)(H2,13,18,19).
What are the key properties of 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide?
2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide has a molecular weight of 377.23 g/mol, XLogP of -0.81, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)acetamide is sourced from PubChem (CID 10833411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).