2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide

C10H13ClN4O4S — CID 62922607

IUPAC2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide
SMILESNC(=O)CN(CC(N)=O)S(=O)(=O)c1c(N)cccc1Cl
InChIInChI=1S/C10H13ClN4O4S/c11-6-2-1-3-7(12)10(6)20(18,19)15(4-8(13)16)5-9(14)17/h1-3H,4-5,12H2,(H2,13,16)(H2,14,17)
InChIKeyARRBTFFOBXSZJV-UHFFFAOYSA-N
MW320.76 g/mol
LogP-1.12
Rot. Bonds6

About 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide

2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide (PubChem CID 62922607) has the molecular formula C10H13ClN4O4S and a molecular weight of 320.76 g/mol. Its IUPAC name is 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide
PubChem CID62922607
Molecular FormulaC10H13ClN4O4S
Molecular Weight320.76 g/mol
Exact Mass320.03
IUPAC Name2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide
SMILESNC(=O)CN(CC(N)=O)S(=O)(=O)c1c(N)cccc1Cl
InChIInChI=1S/C10H13ClN4O4S/c11-6-2-1-3-7(12)10(6)20(18,19)15(4-8(13)16)5-9(14)17/h1-3H,4-5,12H2,(H2,13,16)(H2,14,17)
InChIKeyARRBTFFOBXSZJV-UHFFFAOYSA-N
XLogP-1.12
TPSA149.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.76
LogP ≤ 5-1.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide?
The IUPAC name of 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide (CID 62922607) is 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide.
What is the SMILES notation for 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide?
The canonical SMILES for 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide is NC(=O)CN(CC(N)=O)S(=O)(=O)c1c(N)cccc1Cl.
What is the InChIKey of 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide?
The InChIKey is ARRBTFFOBXSZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN4O4S/c11-6-2-1-3-7(12)10(6)20(18,19)15(4-8(13)16)5-9(14)17/h1-3H,4-5,12H2,(H2,13,16)(H2,14,17).
What are the key properties of 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide?
2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide has a molecular weight of 320.76 g/mol, XLogP of -1.12, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-6-chlorophenyl)sulfonyl-(2-amino-2-oxoethyl)amino]acetamide is sourced from PubChem (CID 62922607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).