6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone

C14H17N5O2 — CID 166252743

IUPAC6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone
SMILESO=C(c1cccn2nnnc12)N1CCOC2(CCCC2)C1
InChIInChI=1S/C14H17N5O2/c20-13(11-4-3-7-19-12(11)15-16-17-19)18-8-9-21-14(10-18)5-1-2-6-14/h3-4,7H,1-2,5-6,8-10H2
InChIKeySRYSYOXJYMYVHD-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.91
Rot. Bonds1

About 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone

6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone (PubChem CID 166252743) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone.

Molecular Properties

Compound Name6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone
PubChem CID166252743
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone
SMILESO=C(c1cccn2nnnc12)N1CCOC2(CCCC2)C1
InChIInChI=1S/C14H17N5O2/c20-13(11-4-3-7-19-12(11)15-16-17-19)18-8-9-21-14(10-18)5-1-2-6-14/h3-4,7H,1-2,5-6,8-10H2
InChIKeySRYSYOXJYMYVHD-UHFFFAOYSA-N
XLogP0.91
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The IUPAC name of 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone (CID 166252743) is 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone.
What is the SMILES notation for 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The canonical SMILES for 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone is O=C(c1cccn2nnnc12)N1CCOC2(CCCC2)C1.
What is the InChIKey of 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The InChIKey is SRYSYOXJYMYVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c20-13(11-4-3-7-19-12(11)15-16-17-19)18-8-9-21-14(10-18)5-1-2-6-14/h3-4,7H,1-2,5-6,8-10H2.
What are the key properties of 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone?
6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone has a molecular weight of 287.32 g/mol, XLogP of 0.91, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxa-9-azaspiro[4.5]decan-9-yl(tetrazolo[1,5-a]pyridin-8-yl)methanone is sourced from PubChem (CID 166252743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).