N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide

C19H21FN2O4S — CID 110607539

IUPACN-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide
SMILESCc1ccc(NS(=O)(=O)CC(C)C(=O)NCC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C19H21FN2O4S/c1-13-3-9-17(10-4-13)22-27(25,26)12-14(2)19(24)21-11-18(23)15-5-7-16(20)8-6-15/h3-10,14,22H,11-12H2,1-2H3,(H,21,24)
InChIKeyMLUAVDHDZZFWPN-UHFFFAOYSA-N
MW392.45 g/mol
LogP2.51
Rot. Bonds8

About N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide

N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide (PubChem CID 110607539) has the molecular formula C19H21FN2O4S and a molecular weight of 392.45 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide
PubChem CID110607539
Molecular FormulaC19H21FN2O4S
Molecular Weight392.45 g/mol
Exact Mass392.12
IUPAC NameN-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide
SMILESCc1ccc(NS(=O)(=O)CC(C)C(=O)NCC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C19H21FN2O4S/c1-13-3-9-17(10-4-13)22-27(25,26)12-14(2)19(24)21-11-18(23)15-5-7-16(20)8-6-15/h3-10,14,22H,11-12H2,1-2H3,(H,21,24)
InChIKeyMLUAVDHDZZFWPN-UHFFFAOYSA-N
XLogP2.51
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.45
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide 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

2-methyl-N-[(2-methylphenyl)methyl]-3-[(4-methylphenyl)sulfamoyl]propanamide
CID 110409028
2-methyl-3-[(4-methylphenyl)sulfamoyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 110620243
N-(2-cyanophenyl)-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide
CID 110428390
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3-[(4-methylphenyl)sulfamoyl]propanamide
CID 110429064
4-[[(2S)-2-carboxypropyl]sulfonylamino]benzoic acid
CID 42220628
2-methyl-3-[(4-methylphenyl)sulfamoyl]-N,N-dipropylpropanamide
CID 110416408
1-[2-(4-fluorophenyl)-2-oxoethyl]-3-propan-2-ylurea
CID 110661716
N,N'-bis(4-fluorophenyl)methanedisulfonamide
CID 90121489
3-[(3-fluorophenyl)sulfamoyl]-N-(2-hydroxy-2-methylpropyl)-2-methylpropanamide
CID 110626814
4-(ethylsulfonylamino)-N-(4-fluorophenyl)-N-methylbenzamide
CID 100785367
3-[(2,4-difluorophenyl)sulfamoyl]-2-methyl-N-(3-methylbutyl)propanamide
CID 110674439
4-[(4-fluorophenyl)sulfamoyl]-N-[(4-methylphenyl)methyl]benzamide
CID 26850932

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide?
The IUPAC name of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide (CID 110607539) is N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide?
The canonical SMILES for N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide is Cc1ccc(NS(=O)(=O)CC(C)C(=O)NCC(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide?
The InChIKey is MLUAVDHDZZFWPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O4S/c1-13-3-9-17(10-4-13)22-27(25,26)12-14(2)19(24)21-11-18(23)15-5-7-16(20)8-6-15/h3-10,14,22H,11-12H2,1-2H3,(H,21,24).
What are the key properties of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide?
N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide has a molecular weight of 392.45 g/mol, XLogP of 2.51, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methyl-3-[(4-methylphenyl)sulfamoyl]propanamide is sourced from PubChem (CID 110607539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).