6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone

C13H19NO2 — CID 102648360

IUPAC6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone
SMILESO=C(C1=CCCCO1)C1CC12CCNCC2
InChIInChI=1S/C13H19NO2/c15-12(11-3-1-2-8-16-11)10-9-13(10)4-6-14-7-5-13/h3,10,14H,1-2,4-9H2
InChIKeyIVSDQAIESJPGPK-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.64
Rot. Bonds2

About 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone

6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone (PubChem CID 102648360) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone.

Molecular Properties

Compound Name6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone
PubChem CID102648360
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone
SMILESO=C(C1=CCCCO1)C1CC12CCNCC2
InChIInChI=1S/C13H19NO2/c15-12(11-3-1-2-8-16-11)10-9-13(10)4-6-14-7-5-13/h3,10,14H,1-2,4-9H2
InChIKeyIVSDQAIESJPGPK-UHFFFAOYSA-N
XLogP1.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dihydro-2H-pyran-6-yl(piperidin-3-yl)methanone
CID 102648268
1-(3,4-dihydro-2H-pyran-6-yl)-2-piperidin-4-ylethanone
CID 102648312
1-(3,4-dihydro-2H-pyran-6-yl)-3-piperidin-3-ylpropan-1-one
CID 102648321
1-(3,4-dihydro-2H-pyran-6-yl)-3-piperidin-4-ylpropan-1-one
CID 102648325
1-(3,4-dihydro-2H-pyran-6-yl)-2-piperidin-3-ylethanone
CID 102648328
3,4-dihydro-2H-pyran-6-yl-(3-ethylpiperidin-3-yl)methanone
CID 102648344
3,4-dihydro-2H-pyran-6-yl-(4-propylpiperidin-4-yl)methanone
CID 102648346
3,4-dihydro-2H-pyran-6-yl-(3-methylpiperidin-3-yl)methanone
CID 102648347
3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone
CID 102648348
1-(3,4-dihydro-2H-pyran-6-yl)-3-piperidin-3-ylbutan-1-one
CID 102648433
1-(3,4-dihydro-2H-pyran-6-yl)-3-pyrrolidin-3-ylpropan-1-one
CID 102648476
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-piperidin-3-ylpropan-1-one
CID 102648492

Frequently Asked Questions

What is the IUPAC name of 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone?
The IUPAC name of 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone (CID 102648360) is 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone.
What is the SMILES notation for 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone?
The canonical SMILES for 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone is O=C(C1=CCCCO1)C1CC12CCNCC2.
What is the InChIKey of 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone?
The InChIKey is IVSDQAIESJPGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c15-12(11-3-1-2-8-16-11)10-9-13(10)4-6-14-7-5-13/h3,10,14H,1-2,4-9H2.
What are the key properties of 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone?
6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone has a molecular weight of 221.30 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone is sourced from PubChem (CID 102648360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).