N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide

C11H15ClN2O3S — CID 103291290

IUPACN-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide
SMILESNCCNC(=O)CS(=O)(=O)Cc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O3S/c12-10-4-2-1-3-9(10)7-18(16,17)8-11(15)14-6-5-13/h1-4H,5-8,13H2,(H,14,15)
InChIKeyFVJOERBWWHEFHF-UHFFFAOYSA-N
MW290.77 g/mol
LogP0.33
Rot. Bonds6

About N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide

N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide (PubChem CID 103291290) has the molecular formula C11H15ClN2O3S and a molecular weight of 290.77 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide
PubChem CID103291290
Molecular FormulaC11H15ClN2O3S
Molecular Weight290.77 g/mol
Exact Mass290.05
IUPAC NameN-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide
SMILESNCCNC(=O)CS(=O)(=O)Cc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O3S/c12-10-4-2-1-3-9(10)7-18(16,17)8-11(15)14-6-5-13/h1-4H,5-8,13H2,(H,14,15)
InChIKeyFVJOERBWWHEFHF-UHFFFAOYSA-N
XLogP0.33
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminoethyl)-2-(2-chlorophenyl)acetamide
CID 12841728
3-amino-N-[2-(2-chlorophenyl)ethyl]propanamide
CID 94684846
2-[(2-chlorophenyl)methylsulfonyl]-N-(3-methylphenyl)acetamide
CID 7731405
N-(2-chloro-4,6-dimethylphenyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide
CID 86925990
N-(3-aminopropyl)-3-(2-chlorophenyl)propanamide
CID 94687820
2-[(2-chlorophenyl)methylsulfonyl]-1-cyclopentylethanone
CID 103291146
4-amino-N-[2-(2-chlorophenyl)ethyl]butanamide;hydrochloride
CID 44818079
2-amino-3-[(2-chlorophenyl)methylsulfonyl]propanamide
CID 103288038
[3-[(2-chlorophenyl)methylsulfonylmethyl]-2-fluorophenyl]methanamine
CID 107120185
N-(2-aminoethyl)-2-(2-chlorophenyl)sulfanylacetamide;hydrochloride
CID 119383840
1-chloro-2-(2-chloroethylsulfonylmethyl)benzene
CID 103288106
N-butyl-2-[(2-cyanophenyl)methylsulfonyl]acetamide
CID 82177601

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide?
The IUPAC name of N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide (CID 103291290) is N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide is NCCNC(=O)CS(=O)(=O)Cc1ccccc1Cl.
What is the InChIKey of N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide?
The InChIKey is FVJOERBWWHEFHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O3S/c12-10-4-2-1-3-9(10)7-18(16,17)8-11(15)14-6-5-13/h1-4H,5-8,13H2,(H,14,15).
What are the key properties of N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide?
N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide has a molecular weight of 290.77 g/mol, XLogP of 0.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-[(2-chlorophenyl)methylsulfonyl]acetamide is sourced from PubChem (CID 103291290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).