2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide

C15H21N5O5 — CID 90330231

IUPAC2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide
SMILESCC(=O)N1CCCC12CN(CC(=O)N[C@H](c1ncno1)[C@@H](C)O)C2=O
InChIInChI=1S/C15H21N5O5/c1-9(21)12(13-16-8-17-25-13)18-11(23)6-19-7-15(14(19)24)4-3-5-20(15)10(2)22/h8-9,12,21H,3-7H2,1-2H3,(H,18,23)/t9-,12+,15?/m1/s1
InChIKeyBYOONOLFIKWYRP-SENKXPHVSA-N
MW351.36 g/mol
LogP-1.17
Rot. Bonds5

About 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide

2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide (PubChem CID 90330231) has the molecular formula C15H21N5O5 and a molecular weight of 351.36 g/mol. Its IUPAC name is 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide.

Molecular Properties

Compound Name2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide
PubChem CID90330231
Molecular FormulaC15H21N5O5
Molecular Weight351.36 g/mol
Exact Mass351.15
IUPAC Name2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide
SMILESCC(=O)N1CCCC12CN(CC(=O)N[C@H](c1ncno1)[C@@H](C)O)C2=O
InChIInChI=1S/C15H21N5O5/c1-9(21)12(13-16-8-17-25-13)18-11(23)6-19-7-15(14(19)24)4-3-5-20(15)10(2)22/h8-9,12,21H,3-7H2,1-2H3,(H,18,23)/t9-,12+,15?/m1/s1
InChIKeyBYOONOLFIKWYRP-SENKXPHVSA-N
XLogP-1.17
TPSA128.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.36
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide?
The IUPAC name of 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide (CID 90330231) is 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide.
What is the SMILES notation for 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide?
The canonical SMILES for 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide is CC(=O)N1CCCC12CN(CC(=O)N[C@H](c1ncno1)[C@@H](C)O)C2=O.
What is the InChIKey of 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide?
The InChIKey is BYOONOLFIKWYRP-SENKXPHVSA-N. The full InChI is InChI=1S/C15H21N5O5/c1-9(21)12(13-16-8-17-25-13)18-11(23)6-19-7-15(14(19)24)4-3-5-20(15)10(2)22/h8-9,12,21H,3-7H2,1-2H3,(H,18,23)/t9-,12+,15?/m1/s1.
What are the key properties of 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide?
2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide has a molecular weight of 351.36 g/mol, XLogP of -1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-N-[(1S,2R)-2-hydroxy-1-(1,2,4-oxadiazol-5-yl)propyl]acetamide is sourced from PubChem (CID 90330231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).