2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide

C19H21ClN2O3S — CID 2215872

IUPAC2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
SMILESCN(CC(=O)Nc1cccc2c1CCCC2)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O3S/c1-22(26(24,25)16-11-9-15(20)10-12-16)13-19(23)21-18-8-4-6-14-5-2-3-7-17(14)18/h4,6,8-12H,2-3,5,7,13H2,1H3,(H,21,23)
InChIKeyGFUBVIXHFAQBLO-UHFFFAOYSA-N
MW392.91 g/mol
LogP3.48
Rot. Bonds5

About 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide

2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 2215872) has the molecular formula C19H21ClN2O3S and a molecular weight of 392.91 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
PubChem CID2215872
Molecular FormulaC19H21ClN2O3S
Molecular Weight392.91 g/mol
Exact Mass392.10
IUPAC Name2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
SMILESCN(CC(=O)Nc1cccc2c1CCCC2)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O3S/c1-22(26(24,25)16-11-9-15(20)10-12-16)13-19(23)21-18-8-4-6-14-5-2-3-7-17(14)18/h4,6,8-12H,2-3,5,7,13H2,1H3,(H,21,23)
InChIKeyGFUBVIXHFAQBLO-UHFFFAOYSA-N
XLogP3.48
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.91
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)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

(2R)-2-[N-(4-Chlorobenzenesulfonyl)-N-(4-dimethylaminobenzyl)amino]-4-methylpentanoic acid amide
CID 59432818
(2S)-1-(4-chlorophenyl)sulfonyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide
CID 2315573
2-(4-chloroanilino)-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 164614642
N-benzyl-2-[2-chloro(phenylsulfonyl)anilino]acetamide
CID 1203977
N-(4-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}phenyl)acetamide
CID 1147635
N-(3-Chlorophenyl)-2-{N-[3-(trifluoromethyl)phenyl]benzenesulfonamido}acetamide
CID 1247140
N-[4-[(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]phenyl]acetamide
CID 1261961
N-(3-chloro-2-methylphenyl)-2-(N-(4-chlorophenyl)phenylsulfonamido)acetamide
CID 1153925
hydroxamate deriv. B32
CID 23645815
N-(2,5-Dimethylphenyl)-2-[N-(2-phenylethyl)benzenesulfonamido]acetamide
CID 1141975
N-(2-Methylpropyl)-2-[N-(2-phenylethyl)4-methylbenzenesulfonamido]acetamide
CID 1141990
2-[N-(3-Chlorophenyl)4-methylbenzenesulfonamido]-N-(2,6-dimethylphenyl)acetamide
CID 1247158

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide (CID 2215872) is 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide is CN(CC(=O)Nc1cccc2c1CCCC2)S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is GFUBVIXHFAQBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O3S/c1-22(26(24,25)16-11-9-15(20)10-12-16)13-19(23)21-18-8-4-6-14-5-2-3-7-17(14)18/h4,6,8-12H,2-3,5,7,13H2,1H3,(H,21,23).
What are the key properties of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 392.91 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 2215872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).