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

C16H24N4O2 — CID 171632128

IUPAC1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one
SMILESCC(Nc1nnc(C2CCC2)o1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C16H24N4O2/c1-11(14(21)20-9-7-16(5-6-16)8-10-20)17-15-19-18-13(22-15)12-3-2-4-12/h11-12H,2-10H2,1H3,(H,17,19)
InChIKeyYHXYMHACDWKEKI-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.54
Rot. Bonds4

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

1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one (PubChem CID 171632128) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one.

Molecular Properties

Compound Name1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one
PubChem CID171632128
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one
SMILESCC(Nc1nnc(C2CCC2)o1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C16H24N4O2/c1-11(14(21)20-9-7-16(5-6-16)8-10-20)17-15-19-18-13(22-15)12-3-2-4-12/h11-12H,2-10H2,1H3,(H,17,19)
InChIKeyYHXYMHACDWKEKI-UHFFFAOYSA-N
XLogP2.54
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one with MolForge

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Related Compounds

5-Cyclobutyl-N-({1-[(4-methylpiperazin-1-YL)methyl]cyclopropyl}methyl)-1,3,4-oxadiazol-2-amine
CID 72897177
(2S)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171631653
1-(6-Azaspiro[2.5]octan-6-yl)-2-[[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]amino]ethanone
CID 171631741
1-(6-Azaspiro[2.5]octan-6-yl)-2-[[5-[2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171631942
1-(6-Azaspiro[2.5]octan-6-yl)-2-[[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171631992
(2R)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171632055
(2S)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171632103
(2R)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[(1R,2S)-2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171632150
1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[(1R)-2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]ethanone
CID 171632289
(2S)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[(1R,2R)-2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171632375
(2S)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[(1R,2S)-2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171632474
(2R)-1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-[2-(trifluoromethyl)cyclopropyl]-1,3,4-oxadiazol-2-yl]amino]propan-1-one
CID 171632487

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]propan-1-one?
The IUPAC name of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one (CID 171632128) is 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one.
What is the SMILES notation for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one?
The canonical SMILES for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one is CC(Nc1nnc(C2CCC2)o1)C(=O)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]propan-1-one?
The InChIKey is YHXYMHACDWKEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-11(14(21)20-9-7-16(5-6-16)8-10-20)17-15-19-18-13(22-15)12-3-2-4-12/h11-12H,2-10H2,1H3,(H,17,19).
What are the key properties of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one?
1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one has a molecular weight of 304.39 g/mol, XLogP of 2.54, 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]propan-1-one is sourced from PubChem (CID 171632128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).