N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide

C19H23N3O4S — CID 7409947

IUPACN-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
SMILESCc1cccc(NC(=O)CNc2cccc(S(=O)(=O)N3CCOCC3)c2)c1
InChIInChI=1S/C19H23N3O4S/c1-15-4-2-6-17(12-15)21-19(23)14-20-16-5-3-7-18(13-16)27(24,25)22-8-10-26-11-9-22/h2-7,12-13,20H,8-11,14H2,1H3,(H,21,23)
InChIKeyQFEKDKVZHHBBTR-UHFFFAOYSA-N
MW389.48 g/mol
LogP2.07
Rot. Bonds6

About N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide

N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide (PubChem CID 7409947) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
PubChem CID7409947
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC NameN-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
SMILESCc1cccc(NC(=O)CNc2cccc(S(=O)(=O)N3CCOCC3)c2)c1
InChIInChI=1S/C19H23N3O4S/c1-15-4-2-6-17(12-15)21-19(23)14-20-16-5-3-7-18(13-16)27(24,25)22-8-10-26-11-9-22/h2-7,12-13,20H,8-11,14H2,1H3,(H,21,23)
InChIKeyQFEKDKVZHHBBTR-UHFFFAOYSA-N
XLogP2.07
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-difluorophenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
CID 9083286
2-(3-chloroanilino)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 26417047
3,5-dimethyl-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 4799420
methyl 3-[[2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl]amino]benzoate
CID 30766141
[2-(3-methylanilino)-2-oxoethyl] 4-morpholin-4-ylsulfonylbenzoate
CID 8705268
2-(4-morpholin-4-ylsulfonylanilino)-N-phenylacetamide
CID 4880247
2-chloro-N-(3-methylphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 1119039
N-(3,4-dimethylphenyl)-2-(4-morpholin-4-ylsulfonylanilino)acetamide
CID 9083306
N-(2-methylcyclohexyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
CID 46797702
N-[3-(dimethylsulfamoyl)phenyl]-2-(3-piperidin-1-ylsulfonylanilino)acetamide
CID 16553103
N-(3-chloro-4-methylphenyl)-2-(3-piperidin-1-ylsulfonylanilino)acetamide
CID 9083457
2-hydroxy-N-(3-methylphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 43853467

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide?
The IUPAC name of N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide (CID 7409947) is N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide.
What is the SMILES notation for N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide?
The canonical SMILES for N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide is Cc1cccc(NC(=O)CNc2cccc(S(=O)(=O)N3CCOCC3)c2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide?
The InChIKey is QFEKDKVZHHBBTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-15-4-2-6-17(12-15)21-19(23)14-20-16-5-3-7-18(13-16)27(24,25)22-8-10-26-11-9-22/h2-7,12-13,20H,8-11,14H2,1H3,(H,21,23).
What are the key properties of N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide?
N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide has a molecular weight of 389.48 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide is sourced from PubChem (CID 7409947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).