N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide

C18H24N4O4S — CID 156549587

IUPACN-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide
SMILESCC(C)c1ccc2c(c1Nc1nc(C(=O)NS(=O)(=O)N(C)C)co1)CCC2
InChIInChI=1S/C18H24N4O4S/c1-11(2)13-9-8-12-6-5-7-14(12)16(13)20-18-19-15(10-26-18)17(23)21-27(24,25)22(3)4/h8-11H,5-7H2,1-4H3,(H,19,20)(H,21,23)
InChIKeyCPGIOWLDUKZBTQ-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.57
Rot. Bonds6

About N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide

N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide (PubChem CID 156549587) has the molecular formula C18H24N4O4S and a molecular weight of 392.48 g/mol. Its IUPAC name is N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide
PubChem CID156549587
Molecular FormulaC18H24N4O4S
Molecular Weight392.48 g/mol
Exact Mass392.15
IUPAC NameN-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide
SMILESCC(C)c1ccc2c(c1Nc1nc(C(=O)NS(=O)(=O)N(C)C)co1)CCC2
InChIInChI=1S/C18H24N4O4S/c1-11(2)13-9-8-12-6-5-7-14(12)16(13)20-18-19-15(10-26-18)17(23)21-27(24,25)22(3)4/h8-11H,5-7H2,1-4H3,(H,19,20)(H,21,23)
InChIKeyCPGIOWLDUKZBTQ-UHFFFAOYSA-N
XLogP2.57
TPSA104.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide with MolForge

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Related Compounds

Nlrp3-IN-25
CID 156548931
US20230399319, Example 2-068
CID 156549519
US20230399319, Example 2-069
CID 156549522
US20230399319, Example 13
CID 156549528
US20230399319, Example 2-040
CID 156549535
US20230399319, Example 68
CID 156549577
US20230399319, Example 2-036
CID 156549697
US20230399319, Example 2-032
CID 156549700
US20230399319, Example 2-016
CID 156549734
US20230399319, Example 70
CID 156549815
US20230399319, Example 69
CID 156549817
US20230399319, Example 2-030
CID 156549832

Frequently Asked Questions

What is the IUPAC name of N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide (CID 156549587) is N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide is CC(C)c1ccc2c(c1Nc1nc(C(=O)NS(=O)(=O)N(C)C)co1)CCC2.
What is the InChIKey of N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide?
The InChIKey is CPGIOWLDUKZBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O4S/c1-11(2)13-9-8-12-6-5-7-14(12)16(13)20-18-19-15(10-26-18)17(23)21-27(24,25)22(3)4/h8-11H,5-7H2,1-4H3,(H,19,20)(H,21,23).
What are the key properties of N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide?
N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide has a molecular weight of 392.48 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylsulfamoyl)-2-[(5-propan-2-yl-2,3-dihydro-1H-inden-4-yl)amino]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 156549587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).