1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate

C25H30N4O6 — CID 146524411

About 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate

1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate (PubChem CID 146524411) has the molecular formula C25H30N4O6 and a molecular weight of 482.54 g/mol. Its IUPAC name is 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate.

Molecular Properties

• Compound Name: 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate
• PubChem CID: 146524411
• Molecular Formula: C25H30N4O6
• Molecular Weight: 482.54 g/mol
• Exact Mass: 482.22
• IUPAC Name: 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate
• SMILES: O=C(NC(C(=O)Nc1ccc2c(c1)NC(=O)C21CCOCC1)C1CCCCC1)OCc1ccno1
• InChI: InChI=1S/C25H30N4O6/c30-22(21(16-4-2-1-3-5-16)29-24(32)34-15-18-8-11-26-35-18)27-17-6-7-19-20(14-17)28-23(31)25(19)9-12-33-13-10-25/h6-8,11,14,16,21H,1-5,9-10,12-13,15H2,(H,27,30)(H,28,31)(H,29,32)
• InChIKey: PIEDHLGVLMKPSJ-UHFFFAOYSA-N
• XLogP: 3.49
• TPSA: 131.79 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	482.54
LogP ≤ 5	3.49
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate?

The IUPAC name of 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate (CID 146524411) is 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate.

What is the SMILES notation for 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate?

The canonical SMILES for 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate is O=C(NC(C(=O)Nc1ccc2c(c1)NC(=O)C21CCOCC1)C1CCCCC1)OCc1ccno1.

What is the InChIKey of 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate?

The InChIKey is PIEDHLGVLMKPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O6/c30-22(21(16-4-2-1-3-5-16)29-24(32)34-15-18-8-11-26-35-18)27-17-6-7-19-20(14-17)28-23(31)25(19)9-12-33-13-10-25/h6-8,11,14,16,21H,1-5,9-10,12-13,15H2,(H,27,30)(H,28,31)(H,29,32).

What are the key properties of 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate?

1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate has a molecular weight of 482.54 g/mol, XLogP of 3.49, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2-oxazol-5-ylmethyl N-[1-cyclohexyl-2-oxo-2-[(2-oxospiro[1H-indole-3,4'-oxane]-6-yl)amino]ethyl]carbamate is sourced from PubChem (CID 146524411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).