2-chloro-N-[4-(sulfonylamino)phenyl]acetamide

C8H7ClN2O3S — CID 87887143

IUPAC2-chloro-N-[4-(sulfonylamino)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(N=S(=O)=O)cc1
InChIInChI=1S/C8H7ClN2O3S/c9-5-8(12)10-6-1-3-7(4-2-6)11-15(13)14/h1-4H,5H2,(H,10,12)
InChIKeyHYBNHDAGFPSTQN-UHFFFAOYSA-N
MW246.68 g/mol
LogP1.56
Rot. Bonds3

About 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide

2-chloro-N-[4-(sulfonylamino)phenyl]acetamide (PubChem CID 87887143) has the molecular formula C8H7ClN2O3S and a molecular weight of 246.68 g/mol. Its IUPAC name is 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[4-(sulfonylamino)phenyl]acetamide
PubChem CID87887143
Molecular FormulaC8H7ClN2O3S
Molecular Weight246.68 g/mol
Exact Mass245.99
IUPAC Name2-chloro-N-[4-(sulfonylamino)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(N=S(=O)=O)cc1
InChIInChI=1S/C8H7ClN2O3S/c9-5-8(12)10-6-1-3-7(4-2-6)11-15(13)14/h1-4H,5H2,(H,10,12)
InChIKeyHYBNHDAGFPSTQN-UHFFFAOYSA-N
XLogP1.56
TPSA75.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.68
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-[4-[[4-[(2-chloroacetyl)amino]phenyl]diazenyl]phenyl]acetamide
CID 86022306
2-chloro-N-[4-[1-(dimethylamino)ethylideneamino]phenyl]acetamide
CID 21392875
N-(4-aminophenyl)-2-chloroacetamide
CID 17325387
2-chloro-N-(4-fluorophenyl)acetamide
CID 532065
2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide
CID 2782070
2-chloroacetyl chloride;2-chloro-N-(4-fluorophenyl)acetamide
CID 161093004
2-chloro-N-[3-[(2-chloroacetyl)amino]phenyl]acetamide
CID 3742979
2-chloro-N-(4-phenylsulfanylphenyl)acetamide
CID 12734393
2-chloro-N-[4-(diaminomethylideneamino)sulfonylphenyl]acetamide
CID 2847090
2-chloro-N-[4-(4-methoxyanilino)phenyl]acetamide
CID 13013378
2-chloro-N-[4-(1,1,2-trifluoroethyl)phenyl]acetamide
CID 166409220
2-chloro-N-(4-pyrimidin-5-ylphenyl)acetamide
CID 166404220

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide (CID 87887143) is 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide is O=C(CCl)Nc1ccc(N=S(=O)=O)cc1.
What is the InChIKey of 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide?
The InChIKey is HYBNHDAGFPSTQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2O3S/c9-5-8(12)10-6-1-3-7(4-2-6)11-15(13)14/h1-4H,5H2,(H,10,12).
What are the key properties of 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide?
2-chloro-N-[4-(sulfonylamino)phenyl]acetamide has a molecular weight of 246.68 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(sulfonylamino)phenyl]acetamide is sourced from PubChem (CID 87887143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).