[(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone

C15H23N3O3 — CID 97473242

IUPAC[(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone
SMILESCOCCN1CCC[C@]12CCCN(C(=O)c1ccno1)C2
InChIInChI=1S/C15H23N3O3/c1-20-11-10-18-9-3-6-15(18)5-2-8-17(12-15)14(19)13-4-7-16-21-13/h4,7H,2-3,5-6,8-12H2,1H3/t15-/m0/s1
InChIKeyPEZINMJSHPJKIF-HNNXBMFYSA-N
MW293.37 g/mol
LogP1.39
Rot. Bonds4

About [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone

[(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone (PubChem CID 97473242) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone.

Molecular Properties

Compound Name[(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone
PubChem CID97473242
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name[(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone
SMILESCOCCN1CCC[C@]12CCCN(C(=O)c1ccno1)C2
InChIInChI=1S/C15H23N3O3/c1-20-11-10-18-9-3-6-15(18)5-2-8-17(12-15)14(19)13-4-7-16-21-13/h4,7H,2-3,5-6,8-12H2,1H3/t15-/m0/s1
InChIKeyPEZINMJSHPJKIF-HNNXBMFYSA-N
XLogP1.39
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone?
The IUPAC name of [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone (CID 97473242) is [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone.
What is the SMILES notation for [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone?
The canonical SMILES for [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone is COCCN1CCC[C@]12CCCN(C(=O)c1ccno1)C2.
What is the InChIKey of [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone?
The InChIKey is PEZINMJSHPJKIF-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-20-11-10-18-9-3-6-15(18)5-2-8-17(12-15)14(19)13-4-7-16-21-13/h4,7H,2-3,5-6,8-12H2,1H3/t15-/m0/s1.
What are the key properties of [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone?
[(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone has a molecular weight of 293.37 g/mol, XLogP of 1.39, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R)-1-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-9-yl]-(1,2-oxazol-5-yl)methanone is sourced from PubChem (CID 97473242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).