2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide

C18H19ClN2O4S — CID 7929121

IUPAC2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2ccccc2Cl)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C18H19ClN2O4S/c1-13-6-7-14(20-18(22)15-4-2-3-5-16(15)19)12-17(13)26(23,24)21-8-10-25-11-9-21/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyXPQHYZCAVQZOCV-UHFFFAOYSA-N
MW394.88 g/mol
LogP2.92
Rot. Bonds4

About 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide

2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide (PubChem CID 7929121) has the molecular formula C18H19ClN2O4S and a molecular weight of 394.88 g/mol. Its IUPAC name is 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide
PubChem CID7929121
Molecular FormulaC18H19ClN2O4S
Molecular Weight394.88 g/mol
Exact Mass394.08
IUPAC Name2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2ccccc2Cl)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C18H19ClN2O4S/c1-13-6-7-14(20-18(22)15-4-2-3-5-16(15)19)12-17(13)26(23,24)21-8-10-25-11-9-21/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyXPQHYZCAVQZOCV-UHFFFAOYSA-N
XLogP2.92
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.88
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide 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

N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 2811587
n-(3-Acetylphenyl)-4-chloro-3-(4-morpholinylsulfonyl)benzamide
CID 1101763
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-phenylacetamide
CID 3959591
N-[3-[(2-chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]-4-fluorobenzamide
CID 4057923
2-chloro-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 4571173
2,4-dichloro-N-(3-fluorophenyl)-5-(4-morpholinylsulfonyl)benzamide
CID 1356130
2,4-dichloro-N-(3,4-difluorophenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 2334818
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 3158002
2-(2-chlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
CID 15945348
2,4-dichloro-5-morpholin-4-ylsulfonyl-N-(3,4,5-trifluorophenyl)benzamide
CID 132191135
4-(Morpholine-4-sulfonyl)-N-phenyl-benzamide
CID 777437
4-chloro-N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 997370

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide?
The IUPAC name of 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide (CID 7929121) is 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide.
What is the SMILES notation for 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide?
The canonical SMILES for 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide is Cc1ccc(NC(=O)c2ccccc2Cl)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide?
The InChIKey is XPQHYZCAVQZOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O4S/c1-13-6-7-14(20-18(22)15-4-2-3-5-16(15)19)12-17(13)26(23,24)21-8-10-25-11-9-21/h2-7,12H,8-11H2,1H3,(H,20,22).
What are the key properties of 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide?
2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide has a molecular weight of 394.88 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide is sourced from PubChem (CID 7929121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).