N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide

C13H24N2O2 — CID 170256764

IUPACN-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide
SMILESCC(C)(C)NC(=O)CN1CC2(CCOCC2)C1
InChIInChI=1S/C13H24N2O2/c1-12(2,3)14-11(16)8-15-9-13(10-15)4-6-17-7-5-13/h4-10H2,1-3H3,(H,14,16)
InChIKeyHYOODRAGIPSLNZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.01
Rot. Bonds2

About N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide

N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide (PubChem CID 170256764) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide
PubChem CID170256764
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide
SMILESCC(C)(C)NC(=O)CN1CC2(CCOCC2)C1
InChIInChI=1S/C13H24N2O2/c1-12(2,3)14-11(16)8-15-9-13(10-15)4-6-17-7-5-13/h4-10H2,1-3H3,(H,14,16)
InChIKeyHYOODRAGIPSLNZ-UHFFFAOYSA-N
XLogP1.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide (CID 170256764) is N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide is CC(C)(C)NC(=O)CN1CC2(CCOCC2)C1.
What is the InChIKey of N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide?
The InChIKey is HYOODRAGIPSLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-12(2,3)14-11(16)8-15-9-13(10-15)4-6-17-7-5-13/h4-10H2,1-3H3,(H,14,16).
What are the key properties of N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide?
N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide has a molecular weight of 240.35 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)acetamide is sourced from PubChem (CID 170256764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).