N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide

C15H25N3O5S — CID 68732117

IUPACN-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide
SMILESCC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)N2CCOCC2)on1
InChIInChI=1S/C15H25N3O5S/c1-14(2,3)11-10-12(23-17-11)16-13(19)15(4,5)24(20,21)18-6-8-22-9-7-18/h10H,6-9H2,1-5H3,(H,16,19)
InChIKeyOIBDBOWITPGFSS-UHFFFAOYSA-N
MW359.45 g/mol
LogP1.35
Rot. Bonds4

About N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide

N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide (PubChem CID 68732117) has the molecular formula C15H25N3O5S and a molecular weight of 359.45 g/mol. Its IUPAC name is N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide.

Molecular Properties

Compound NameN-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide
PubChem CID68732117
Molecular FormulaC15H25N3O5S
Molecular Weight359.45 g/mol
Exact Mass359.15
IUPAC NameN-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide
SMILESCC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)N2CCOCC2)on1
InChIInChI=1S/C15H25N3O5S/c1-14(2,3)11-10-12(23-17-11)16-13(19)15(4,5)24(20,21)18-6-8-22-9-7-18/h10H,6-9H2,1-5H3,(H,16,19)
InChIKeyOIBDBOWITPGFSS-UHFFFAOYSA-N
XLogP1.35
TPSA101.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide?
The IUPAC name of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide (CID 68732117) is N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide.
What is the SMILES notation for N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide?
The canonical SMILES for N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide is CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)N2CCOCC2)on1.
What is the InChIKey of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide?
The InChIKey is OIBDBOWITPGFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O5S/c1-14(2,3)11-10-12(23-17-11)16-13(19)15(4,5)24(20,21)18-6-8-22-9-7-18/h10H,6-9H2,1-5H3,(H,16,19).
What are the key properties of N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide?
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide has a molecular weight of 359.45 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butyl-1,2-oxazol-5-yl)-2-methyl-2-morpholin-4-ylsulfonylpropanamide is sourced from PubChem (CID 68732117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).