N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide

C17H17N3O4S — CID 10338501

IUPACN-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide
SMILESCC(=O)Nc1cccc2c(S(=O)(=O)Nc3onc(C)c3C)cccc12
InChIInChI=1S/C17H17N3O4S/c1-10-11(2)19-24-17(10)20-25(22,23)16-9-5-6-13-14(16)7-4-8-15(13)18-12(3)21/h4-9,20H,1-3H3,(H,18,21)
InChIKeyRUCGYYIEJGBLLO-UHFFFAOYSA-N
MW359.41 g/mol
LogP3.20
Rot. Bonds4

About N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide

N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide (PubChem CID 10338501) has the molecular formula C17H17N3O4S and a molecular weight of 359.41 g/mol. Its IUPAC name is N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide.

Molecular Properties

Compound NameN-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide
PubChem CID10338501
Molecular FormulaC17H17N3O4S
Molecular Weight359.41 g/mol
Exact Mass359.09
IUPAC NameN-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide
SMILESCC(=O)Nc1cccc2c(S(=O)(=O)Nc3onc(C)c3C)cccc12
InChIInChI=1S/C17H17N3O4S/c1-10-11(2)19-24-17(10)20-25(22,23)16-9-5-6-13-14(16)7-4-8-15(13)18-12(3)21/h4-9,20H,1-3H3,(H,18,21)
InChIKeyRUCGYYIEJGBLLO-UHFFFAOYSA-N
XLogP3.20
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide?
The IUPAC name of N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide (CID 10338501) is N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide.
What is the SMILES notation for N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide?
The canonical SMILES for N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide is CC(=O)Nc1cccc2c(S(=O)(=O)Nc3onc(C)c3C)cccc12.
What is the InChIKey of N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide?
The InChIKey is RUCGYYIEJGBLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O4S/c1-10-11(2)19-24-17(10)20-25(22,23)16-9-5-6-13-14(16)7-4-8-15(13)18-12(3)21/h4-9,20H,1-3H3,(H,18,21).
What are the key properties of N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide?
N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide has a molecular weight of 359.41 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]acetamide is sourced from PubChem (CID 10338501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).