2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide

C11H15ClN2O2S — CID 81188971

IUPAC2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide
SMILESCC(N)CS(=O)CC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2O2S/c1-8(13)6-17(16)7-11(15)14-10-4-2-3-9(12)5-10/h2-5,8H,6-7,13H2,1H3,(H,14,15)
InChIKeyFMADTUUOYIMYBS-UHFFFAOYSA-N
MW274.77 g/mol
LogP1.37
Rot. Bonds5

About 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide

2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide (PubChem CID 81188971) has the molecular formula C11H15ClN2O2S and a molecular weight of 274.77 g/mol. Its IUPAC name is 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide
PubChem CID81188971
Molecular FormulaC11H15ClN2O2S
Molecular Weight274.77 g/mol
Exact Mass274.05
IUPAC Name2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide
SMILESCC(N)CS(=O)CC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2O2S/c1-8(13)6-17(16)7-11(15)14-10-4-2-3-9(12)5-10/h2-5,8H,6-7,13H2,1H3,(H,14,15)
InChIKeyFMADTUUOYIMYBS-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

Analyze 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-(3-chlorophenyl)hexanamide
CID 82849187
(2R)-2-amino-N-[2-(3-chloroanilino)-2-oxoethyl]-N-methylpropanamide;hydrochloride
CID 119294392
2-(2-aminobutylsulfinyl)-N-phenylacetamide
CID 81193786
5-(3-chloroanilino)-3-methyl-5-oxopentanoic acid
CID 62965895
2-[(R)-(3-chlorophenyl)methylsulfinyl]-N-(3-fluorophenyl)acetamide
CID 95169102
N,N'-bis(3-chlorophenyl)pentanediamide
CID 1011389
3-(aminomethyl)-N-(3-chlorophenyl)hexanamide
CID 112516422
3-[2-(3-methoxyanilino)-2-oxoethyl]sulfinyl-2-methylpropanoic acid
CID 64915166
(2S,3S)-2,3-dichloro-N-(3-chlorophenyl)butanamide
CID 7385868
N-(3-chlorophenyl)-2-methylbutanamide
CID 4636150
(2R,3S)-2,3-dichloro-N-(3-chlorophenyl)butanamide
CID 7385866
(2S)-2-amino-N-(3-chlorophenyl)butanamide;hydrochloride
CID 119262061

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide (CID 81188971) is 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide is CC(N)CS(=O)CC(=O)Nc1cccc(Cl)c1.
What is the InChIKey of 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide?
The InChIKey is FMADTUUOYIMYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2S/c1-8(13)6-17(16)7-11(15)14-10-4-2-3-9(12)5-10/h2-5,8H,6-7,13H2,1H3,(H,14,15).
What are the key properties of 2-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide?
2-(2-aminopropylsulfinyl)-N-(3-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-(2-aminopropylsulfinyl)-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 81188971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).