6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile

C14H17N3O2 — CID 102930474

IUPAC6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile
SMILESN#Cc1ccc(OC2COC3(CCNCC3)C2)nc1
InChIInChI=1S/C14H17N3O2/c15-8-11-1-2-13(17-9-11)19-12-7-14(18-10-12)3-5-16-6-4-14/h1-2,9,12,16H,3-7,10H2
InChIKeyVZNALGMJPDHSTH-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.24
Rot. Bonds2

About 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile

6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile (PubChem CID 102930474) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile
PubChem CID102930474
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile
SMILESN#Cc1ccc(OC2COC3(CCNCC3)C2)nc1
InChIInChI=1S/C14H17N3O2/c15-8-11-1-2-13(17-9-11)19-12-7-14(18-10-12)3-5-16-6-4-14/h1-2,9,12,16H,3-7,10H2
InChIKeyVZNALGMJPDHSTH-UHFFFAOYSA-N
XLogP1.24
TPSA67.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-fluoro-4-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)benzonitrile
CID 102930597
6-(1,4-dioxaspiro[4.5]decan-8-yloxy)pyridine-3-carbonitrile
CID 119099168
(3R,5S)-3-pyridin-2-yloxy-1-oxa-7-azaspiro[4.4]nonane
CID 97420064
3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930458
2-bromo-4-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)benzonitrile
CID 107281588
3-[[4-(trifluoromethyl)-2-pyridinyl]oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930637
3-(6-propylpyrimidin-4-yl)oxy-1-oxa-8-azaspiro[4.5]decane
CID 102930624
(3S)-3-(4-fluorophenoxy)-1-oxa-8-azaspiro[4.5]decane
CID 124938709
6-(3,3,5-trimethylcyclohexyl)oxypyridine-3-carbonitrile
CID 43128070
3-(6-ethoxy-5-methylpyrimidin-4-yl)oxy-1-oxa-8-azaspiro[4.5]decane
CID 102930455
3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930602
6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-2-carboxamide
CID 102930635

Frequently Asked Questions

What is the IUPAC name of 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile?
The IUPAC name of 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile (CID 102930474) is 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile?
The canonical SMILES for 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile is N#Cc1ccc(OC2COC3(CCNCC3)C2)nc1.
What is the InChIKey of 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile?
The InChIKey is VZNALGMJPDHSTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c15-8-11-1-2-13(17-9-11)19-12-7-14(18-10-12)3-5-16-6-4-14/h1-2,9,12,16H,3-7,10H2.
What are the key properties of 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile?
6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile has a molecular weight of 259.31 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pyridine-3-carbonitrile is sourced from PubChem (CID 102930474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).