2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide

C14H12Cl2N2O2S — CID 81201202

IUPAC2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
SMILESNc1ccc(Cl)c(S(=O)CC(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C14H12Cl2N2O2S/c15-10-3-1-2-4-12(10)18-14(19)8-21(20)13-7-9(17)5-6-11(13)16/h1-7H,8,17H2,(H,18,19)
InChIKeyAXHHPQKKCIPTTC-UHFFFAOYSA-N
MW343.24 g/mol
LogP3.32
Rot. Bonds4

About 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide

2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide (PubChem CID 81201202) has the molecular formula C14H12Cl2N2O2S and a molecular weight of 343.24 g/mol. Its IUPAC name is 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
PubChem CID81201202
Molecular FormulaC14H12Cl2N2O2S
Molecular Weight343.24 g/mol
Exact Mass342.00
IUPAC Name2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
SMILESNc1ccc(Cl)c(S(=O)CC(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C14H12Cl2N2O2S/c15-10-3-1-2-4-12(10)18-14(19)8-21(20)13-7-9(17)5-6-11(13)16/h1-7H,8,17H2,(H,18,19)
InChIKeyAXHHPQKKCIPTTC-UHFFFAOYSA-N
XLogP3.32
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.24
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-methylphenyl)acetamide
CID 81202410
N-(5-amino-2-chlorophenyl)-2-(2-bromophenyl)sulfinylacetamide
CID 61287005
2-(2-amino-5-fluorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
CID 81192638
2-(5-amino-2-methylphenyl)sulfinyl-N-(2-methylphenyl)acetamide
CID 81191402
2-(5-amino-2-chlorophenyl)sulfinyl-N-propylacetamide
CID 81201988
N-(2-chlorophenyl)-2-[(S)-(3-chlorophenyl)sulfinyl]acetamide
CID 40520627
N-(4-amino-2-chlorophenyl)-2-(4-chlorophenyl)sulfinylacetamide
CID 61302386
2-(5-amino-2-chlorophenyl)sulfinyl-N-(cyclopropylmethyl)acetamide
CID 81201983
1-(5-amino-2-chlorophenyl)-3-(2-chlorophenyl)urea
CID 43551327
2-(4-amino-2-methylphenyl)sulfinyl-N-(2-methylphenyl)acetamide
CID 81184334
2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-cyanoethyl)acetamide
CID 81202421
N-(4-amino-2-chlorophenyl)-2-methylsulfinylacetamide
CID 61287457

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide (CID 81201202) is 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide is Nc1ccc(Cl)c(S(=O)CC(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
The InChIKey is AXHHPQKKCIPTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2S/c15-10-3-1-2-4-12(10)18-14(19)8-21(20)13-7-9(17)5-6-11(13)16/h1-7H,8,17H2,(H,18,19).
What are the key properties of 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide?
2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide has a molecular weight of 343.24 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 81201202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).