1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone

C15H22N4O2 — CID 171631728

IUPAC1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone
SMILESO=C(CNc1nnc(C2CCC2)o1)N1CCC2(CC1)CC2
InChIInChI=1S/C15H22N4O2/c20-12(19-8-6-15(4-5-15)7-9-19)10-16-14-18-17-13(21-14)11-2-1-3-11/h11H,1-10H2,(H,16,18)
InChIKeyHNEHCZXGQGUBOH-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.15
Rot. Bonds4

About 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone

1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone (PubChem CID 171631728) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone.

Molecular Properties

Compound Name1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone
PubChem CID171631728
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone
SMILESO=C(CNc1nnc(C2CCC2)o1)N1CCC2(CC1)CC2
InChIInChI=1S/C15H22N4O2/c20-12(19-8-6-15(4-5-15)7-9-19)10-16-14-18-17-13(21-14)11-2-1-3-11/h11H,1-10H2,(H,16,18)
InChIKeyHNEHCZXGQGUBOH-UHFFFAOYSA-N
XLogP2.15
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone?
The IUPAC name of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone (CID 171631728) is 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone.
What is the SMILES notation for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone?
The canonical SMILES for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone is O=C(CNc1nnc(C2CCC2)o1)N1CCC2(CC1)CC2.
What is the InChIKey of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone?
The InChIKey is HNEHCZXGQGUBOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-12(19-8-6-15(4-5-15)7-9-19)10-16-14-18-17-13(21-14)11-2-1-3-11/h11H,1-10H2,(H,16,18).
What are the key properties of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone?
1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone has a molecular weight of 290.37 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone is sourced from PubChem (CID 171631728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).