N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide

C19H22BrN3O4S — CID 26438150

IUPACN-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide
SMILESCc1ccc(NCC(=O)Nc2ccc(Br)cc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H22BrN3O4S/c1-14-2-5-17(12-18(14)28(25,26)23-8-10-27-11-9-23)21-13-19(24)22-16-6-3-15(20)4-7-16/h2-7,12,21H,8-11,13H2,1H3,(H,22,24)
InChIKeyIUDKBOLYTRWOSI-UHFFFAOYSA-N
MW468.37 g/mol
LogP2.83
Rot. Bonds6

About N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide

N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide (PubChem CID 26438150) has the molecular formula C19H22BrN3O4S and a molecular weight of 468.37 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide
PubChem CID26438150
Molecular FormulaC19H22BrN3O4S
Molecular Weight468.37 g/mol
Exact Mass467.05
IUPAC NameN-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide
SMILESCc1ccc(NCC(=O)Nc2ccc(Br)cc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H22BrN3O4S/c1-14-2-5-17(12-18(14)28(25,26)23-8-10-27-11-9-23)21-13-19(24)22-16-6-3-15(20)4-7-16/h2-7,12,21H,8-11,13H2,1H3,(H,22,24)
InChIKeyIUDKBOLYTRWOSI-UHFFFAOYSA-N
XLogP2.83
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.37
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-N-phenylacetamide
CID 9100328
2-chloro-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide
CID 3409401
5-bromo-N-[2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]furan-2-carboxamide
CID 24620415
2-(3-fluoro-4-methylanilino)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 9100033
3-(3-bromophenyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)propanamide
CID 29436303
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(4-methylphenyl)sulfanylacetamide
CID 16528218
2-(4-methoxy-3-morpholin-4-ylsulfonylanilino)-N-(4-methoxyphenyl)acetamide
CID 4289049
N-(3,4-dimethylphenyl)-2-(4-morpholin-4-ylsulfonylanilino)acetamide
CID 9083306
N-(4-bromo-2-fluorophenyl)-2-(4-methyl-3-piperidin-1-ylsulfonylanilino)acetamide
CID 26438243
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylsulfanylacetamide
CID 16515870
2-(3-chloro-4-methoxyanilino)-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)acetamide
CID 26438859
(3R)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-phenylbutanamide
CID 7689032

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide?
The IUPAC name of N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide (CID 26438150) is N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide is Cc1ccc(NCC(=O)Nc2ccc(Br)cc2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide?
The InChIKey is IUDKBOLYTRWOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22BrN3O4S/c1-14-2-5-17(12-18(14)28(25,26)23-8-10-27-11-9-23)21-13-19(24)22-16-6-3-15(20)4-7-16/h2-7,12,21H,8-11,13H2,1H3,(H,22,24).
What are the key properties of N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide?
N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide has a molecular weight of 468.37 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(4-methyl-3-morpholin-4-ylsulfonylanilino)acetamide is sourced from PubChem (CID 26438150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).