2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide

C11H15ClN2O2S — CID 81186906

IUPAC2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide
SMILESCC(CN)S(=O)CC(=O)Nc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O2S/c1-8(6-13)17(16)7-11(15)14-10-5-3-2-4-9(10)12/h2-5,8H,6-7,13H2,1H3,(H,14,15)
InChIKeyGRICPJPKNWKNNS-UHFFFAOYSA-N
MW274.77 g/mol
LogP1.37
Rot. Bonds5

About 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide

2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide (PubChem CID 81186906) has the molecular formula C11H15ClN2O2S and a molecular weight of 274.77 g/mol. Its IUPAC name is 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide
PubChem CID81186906
Molecular FormulaC11H15ClN2O2S
Molecular Weight274.77 g/mol
Exact Mass274.05
IUPAC Name2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide
SMILESCC(CN)S(=O)CC(=O)Nc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O2S/c1-8(6-13)17(16)7-11(15)14-10-5-3-2-4-9(10)12/h2-5,8H,6-7,13H2,1H3,(H,14,15)
InChIKeyGRICPJPKNWKNNS-UHFFFAOYSA-N
XLogP1.37
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.77
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminopropan-2-ylsulfinyl)-N-(2-methylphenyl)acetamide
CID 81187833
2-[2-(2-chloroanilino)-2-oxoethyl]sulfinylpropanoic acid
CID 54883256
3-amino-N-(2-chlorophenyl)propanamide
CID 22692042
2-amino-N-(2-chlorophenyl)acetamide;hydrochloride
CID 51051964
2-(5-amino-2-chlorophenyl)sulfinyl-N-(2-chlorophenyl)acetamide
CID 81201202
5-(2-chloroanilino)-3-methyl-5-oxopentanoic acid
CID 45126722
N-(2-chlorophenyl)-2-[(S)-(3-chlorophenyl)sulfinyl]acetamide
CID 40520627
2-amino-N-(2-chlorophenyl)propanamide
CID 24704539
N-(2-chlorophenyl)hexanamide
CID 4644560
N-(2-chlorophenyl)-2-sulfanylacetamide
CID 679489
5-(2-chloroanilino)-2-ethyl-3-methyl-5-oxopentanoic acid
CID 3152083
N-(2-chlorophenyl)octanamide
CID 2292983

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide (CID 81186906) is 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide is CC(CN)S(=O)CC(=O)Nc1ccccc1Cl.
What is the InChIKey of 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide?
The InChIKey is GRICPJPKNWKNNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2S/c1-8(6-13)17(16)7-11(15)14-10-5-3-2-4-9(10)12/h2-5,8H,6-7,13H2,1H3,(H,14,15).
What are the key properties of 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide?
2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide has a molecular weight of 274.77 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminopropan-2-ylsulfinyl)-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 81186906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).