2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide

C16H18ClN3O3S — CID 9058026

IUPAC2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide
SMILESCN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1ccccc1Cl
InChIInChI=1S/C16H18ClN3O3S/c1-20(10-12-4-2-3-5-15(12)17)11-16(21)19-13-6-8-14(9-7-13)24(18,22)23/h2-9H,10-11H2,1H3,(H,19,21)(H2,18,22,23)
InChIKeyUBXVCIJTRZSZGR-UHFFFAOYSA-N
MW367.86 g/mol
LogP2.06
Rot. Bonds6

About 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide

2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide (PubChem CID 9058026) has the molecular formula C16H18ClN3O3S and a molecular weight of 367.86 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide
PubChem CID9058026
Molecular FormulaC16H18ClN3O3S
Molecular Weight367.86 g/mol
Exact Mass367.08
IUPAC Name2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide
SMILESCN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1ccccc1Cl
InChIInChI=1S/C16H18ClN3O3S/c1-20(10-12-4-2-3-5-15(12)17)11-16(21)19-13-6-8-14(9-7-13)24(18,22)23/h2-9H,10-11H2,1H3,(H,19,21)(H2,18,22,23)
InChIKeyUBXVCIJTRZSZGR-UHFFFAOYSA-N
XLogP2.06
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.86
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-(4-sulfamoylphenyl)acetamide
CID 2526439
N-(4-acetylphenyl)-2-[(2-chlorophenyl)methyl-methylamino]acetamide
CID 9057922
N-(3-chloro-4-fluorophenyl)-2-[(2-chlorophenyl)methyl-methylamino]acetamide
CID 9057792
N-(4-acetamidophenyl)-2-[methyl-[(2-sulfamoylphenyl)methyl]amino]acetamide
CID 166229297
3-[(2,4-dichlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)propanamide
CID 24681104
2-[(2-chlorophenyl)methyl-methylamino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 8542629
2-[(2-chlorophenyl)methyl-methylamino]-N-(2,3,5,6-tetrachlorophenyl)acetamide
CID 18282633
2-[(2,3-dichlorophenyl)methyl-methylamino]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 2698664
2-[(2-chlorophenyl)methyl-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 26623732
N-(4-acetamidophenyl)-2-[(2-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]acetamide
CID 126083141
4-[[2-[(2-chlorophenyl)methyl-methylamino]acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 4788052
N-(3-chloro-2-methylphenyl)-2-[(2-chlorophenyl)methyl-methylamino]acetamide
CID 9057796

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide?
The IUPAC name of 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide (CID 9058026) is 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide is CN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1ccccc1Cl.
What is the InChIKey of 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide?
The InChIKey is UBXVCIJTRZSZGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O3S/c1-20(10-12-4-2-3-5-15(12)17)11-16(21)19-13-6-8-14(9-7-13)24(18,22)23/h2-9H,10-11H2,1H3,(H,19,21)(H2,18,22,23).
What are the key properties of 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide?
2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide has a molecular weight of 367.86 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 9058026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).