N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide

C17H25N3O3S2 — CID 119329159

IUPACN-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C2CSCN2)c1
InChIInChI=1S/C17H25N3O3S2/c1-20(14-7-3-2-4-8-14)25(22,23)15-9-5-6-13(10-15)19-17(21)16-11-24-12-18-16/h5-6,9-10,14,16,18H,2-4,7-8,11-12H2,1H3,(H,19,21)
InChIKeyZVDTXLQEAPBQNW-UHFFFAOYSA-N
MW383.54 g/mol
LogP2.24
Rot. Bonds5

About N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide

N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 119329159) has the molecular formula C17H25N3O3S2 and a molecular weight of 383.54 g/mol. Its IUPAC name is N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide
PubChem CID119329159
Molecular FormulaC17H25N3O3S2
Molecular Weight383.54 g/mol
Exact Mass383.13
IUPAC NameN-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C2CSCN2)c1
InChIInChI=1S/C17H25N3O3S2/c1-20(14-7-3-2-4-8-14)25(22,23)15-9-5-6-13(10-15)19-17(21)16-11-24-12-18-16/h5-6,9-10,14,16,18H,2-4,7-8,11-12H2,1H3,(H,19,21)
InChIKeyZVDTXLQEAPBQNW-UHFFFAOYSA-N
XLogP2.24
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.54
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 54862152
N-[3-(tert-butylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 119270867
3-amino-N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119793490
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
N-[4-(dimethylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43702511
N-[3-[(dimethylamino)methyl]phenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119853195
N-[3-(propylsulfonylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 119329973
N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119830904
N-[3-(propanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61250253
N-(3-ethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24703459
N-[3-(methylcarbamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 61258442
N-[3-(2-methylpropanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119281758

Frequently Asked Questions

What is the IUPAC name of N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide (CID 119329159) is N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide is CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C2CSCN2)c1.
What is the InChIKey of N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is ZVDTXLQEAPBQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3S2/c1-20(14-7-3-2-4-8-14)25(22,23)15-9-5-6-13(10-15)19-17(21)16-11-24-12-18-16/h5-6,9-10,14,16,18H,2-4,7-8,11-12H2,1H3,(H,19,21).
What are the key properties of N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide?
N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 383.54 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 119329159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).