2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide

C19H21ClN2O3S — CID 55339904

IUPAC2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NC2CCc3ccccc3C2)c1
InChIInChI=1S/C19H21ClN2O3S/c1-22(2)26(24,25)16-9-10-18(20)17(12-16)19(23)21-15-8-7-13-5-3-4-6-14(13)11-15/h3-6,9-10,12,15H,7-8,11H2,1-2H3,(H,21,23)
InChIKeyHJWGNFBCZHCYLO-UHFFFAOYSA-N
MW392.91 g/mol
LogP2.88
Rot. Bonds4

About 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide

2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide (PubChem CID 55339904) has the molecular formula C19H21ClN2O3S and a molecular weight of 392.91 g/mol. Its IUPAC name is 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide.

Molecular Properties

Compound Name2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
PubChem CID55339904
Molecular FormulaC19H21ClN2O3S
Molecular Weight392.91 g/mol
Exact Mass392.10
IUPAC Name2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NC2CCc3ccccc3C2)c1
InChIInChI=1S/C19H21ClN2O3S/c1-22(2)26(24,25)16-9-10-18(20)17(12-16)19(23)21-15-8-7-13-5-3-4-6-14(13)11-15/h3-6,9-10,12,15H,7-8,11H2,1-2H3,(H,21,23)
InChIKeyHJWGNFBCZHCYLO-UHFFFAOYSA-N
XLogP2.88
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.91
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclopentyl-5-(dimethylsulfamoyl)benzamide
CID 26413035
2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 106501740
2-chloro-N-(3,4-dihydro-2H-chromen-4-yl)-5-(dimethylsulfamoyl)benzamide
CID 18115177
2-chloro-N-(2-chlorophenyl)-5-(dimethylsulfamoyl)benzamide
CID 1310418
2-methyl-5-methylsulfonyl-N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)benzamide
CID 23509730
2-chloro-6-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 20872301
2-chloro-N-cyclopropyl-5-[(4-fluorophenyl)-methylsulfamoyl]benzamide
CID 27537238
4-hydroxy-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 103865106
2-chloro-5-(dimethylsulfamoyl)-N-(2-iodophenyl)benzamide
CID 3413626
5-amino-2-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 10493163
2-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 60630141
6-methyl-4-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1H-pyridine-3-carboxamide
CID 103717380

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
The IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide (CID 55339904) is 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide.
What is the SMILES notation for 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
The canonical SMILES for 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide is CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NC2CCc3ccccc3C2)c1.
What is the InChIKey of 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
The InChIKey is HJWGNFBCZHCYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O3S/c1-22(2)26(24,25)16-9-10-18(20)17(12-16)19(23)21-15-8-7-13-5-3-4-6-14(13)11-15/h3-6,9-10,12,15H,7-8,11H2,1-2H3,(H,21,23).
What are the key properties of 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide?
2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide has a molecular weight of 392.91 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(dimethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide is sourced from PubChem (CID 55339904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).