5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole

C10H15N3O — CID 10081310

IUPAC5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole
SMILESc1cc(N2CCC3(CCNC3)C2)on1
InChIInChI=1S/C10H15N3O/c1-4-12-14-9(1)13-6-3-10(8-13)2-5-11-7-10/h1,4,11H,2-3,5-8H2
InChIKeyFHHBYKPIGHOHQK-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.86
Rot. Bonds1

About 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole

5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole (PubChem CID 10081310) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole
PubChem CID10081310
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole
SMILESc1cc(N2CCC3(CCNC3)C2)on1
InChIInChI=1S/C10H15N3O/c1-4-12-14-9(1)13-6-3-10(8-13)2-5-11-7-10/h1,4,11H,2-3,5-8H2
InChIKeyFHHBYKPIGHOHQK-UHFFFAOYSA-N
XLogP0.86
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole?
The IUPAC name of 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole (CID 10081310) is 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole.
What is the SMILES notation for 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole?
The canonical SMILES for 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole is c1cc(N2CCC3(CCNC3)C2)on1.
What is the InChIKey of 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole?
The InChIKey is FHHBYKPIGHOHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-4-12-14-9(1)13-6-3-10(8-13)2-5-11-7-10/h1,4,11H,2-3,5-8H2.
What are the key properties of 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole?
5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole has a molecular weight of 193.25 g/mol, XLogP of 0.86, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole is sourced from PubChem (CID 10081310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).