N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide

C19H20N4O3S — CID 67663105

IUPACN-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide
SMILESCNC(=O)C(C)c1cc(-c2ccccc2)n(-c2ccc(S(N)(=O)=O)cc2)n1
InChIInChI=1S/C19H20N4O3S/c1-13(19(24)21-2)17-12-18(14-6-4-3-5-7-14)23(22-17)15-8-10-16(11-9-15)27(20,25)26/h3-13H,1-2H3,(H,21,24)(H2,20,25,26)
InChIKeyAYZKMQPHAFYBFW-UHFFFAOYSA-N
MW384.46 g/mol
LogP2.04
Rot. Bonds5

About N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide

N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide (PubChem CID 67663105) has the molecular formula C19H20N4O3S and a molecular weight of 384.46 g/mol. Its IUPAC name is N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide.

Molecular Properties

Compound NameN-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide
PubChem CID67663105
Molecular FormulaC19H20N4O3S
Molecular Weight384.46 g/mol
Exact Mass384.13
IUPAC NameN-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide
SMILESCNC(=O)C(C)c1cc(-c2ccccc2)n(-c2ccc(S(N)(=O)=O)cc2)n1
InChIInChI=1S/C19H20N4O3S/c1-13(19(24)21-2)17-12-18(14-6-4-3-5-7-14)23(22-17)15-8-10-16(11-9-15)27(20,25)26/h3-13H,1-2H3,(H,21,24)(H2,20,25,26)
InChIKeyAYZKMQPHAFYBFW-UHFFFAOYSA-N
XLogP2.04
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(4-methylphenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid
CID 69435721
4-[3-(methylamino)-5-phenylpyrazol-1-yl]benzenesulfonamide
CID 22315384
1-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]ethyl 2-cyanoprop-2-enoate
CID 140973763
4-(3,5-diphenylpyrazol-1-yl)benzenesulfonamide
CID 3878623
4-[3-(difluoromethyl)-1-(4-sulfamoylphenyl)pyrazol-5-yl]benzoic acid
CID 10668272
1-methyl-1-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]urea
CID 22315588
N-methyl-N-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide
CID 67663106
2-[4-bromo-5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid
CID 22315393
5-(4-methoxyphenyl)-N-methyl-1-(4-sulfamoylphenyl)pyrazole-3-carboxamide
CID 22315479
carbon dioxide;[7-(methylamino)-1-methylperoxy-4,7-dioxo-6-[[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]methylselanylsulfanylmethyl]heptyl]azanium
CID 159892021
[1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 1,3-diphenylpyrazole-5-carboxylate
CID 4856521
4-[3-(difluoromethyl)-5-(2-methylsulfanylphenyl)pyrazol-1-yl]benzenesulfonamide
CID 67743721

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide?
The IUPAC name of N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide (CID 67663105) is N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide.
What is the SMILES notation for N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide?
The canonical SMILES for N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide is CNC(=O)C(C)c1cc(-c2ccccc2)n(-c2ccc(S(N)(=O)=O)cc2)n1.
What is the InChIKey of N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide?
The InChIKey is AYZKMQPHAFYBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3S/c1-13(19(24)21-2)17-12-18(14-6-4-3-5-7-14)23(22-17)15-8-10-16(11-9-15)27(20,25)26/h3-13H,1-2H3,(H,21,24)(H2,20,25,26).
What are the key properties of N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide?
N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide has a molecular weight of 384.46 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[5-phenyl-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanamide is sourced from PubChem (CID 67663105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).