3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane

C18H33N3O — CID 18525272

IUPAC3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane
SMILESC1CCN(C2CCN(C3COC4(CCNCC4)C3)CC2)CC1
InChIInChI=1S/C18H33N3O/c1-2-10-20(11-3-1)16-4-12-21(13-5-16)17-14-18(22-15-17)6-8-19-9-7-18/h16-17,19H,1-15H2
InChIKeyZREJDHYRNJQOCB-UHFFFAOYSA-N
MW307.48 g/mol
LogP1.85
Rot. Bonds2

About 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane

3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane (PubChem CID 18525272) has the molecular formula C18H33N3O and a molecular weight of 307.48 g/mol. Its IUPAC name is 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane
PubChem CID18525272
Molecular FormulaC18H33N3O
Molecular Weight307.48 g/mol
Exact Mass307.26
IUPAC Name3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane
SMILESC1CCN(C2CCN(C3COC4(CCNCC4)C3)CC2)CC1
InChIInChI=1S/C18H33N3O/c1-2-10-20(11-3-1)16-4-12-21(13-5-16)17-14-18(22-15-17)6-8-19-9-7-18/h16-17,19H,1-15H2
InChIKeyZREJDHYRNJQOCB-UHFFFAOYSA-N
XLogP1.85
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-Morpholinyl)-1-oxa-8-azaspiro[4.5]decane dihydrochloride
CID 6473701
1-Oxa-8-azaspiro[4.5]decane, 3-(4-morpholinyl)-, dihydrochloride
CID 6473700
(3S)-3-morpholin-4-yl-1-oxa-8-azaspiro[4.5]decane
CID 8068850
(3R)-3-morpholin-4-yl-1-oxa-8-azaspiro[4.5]decane
CID 8068852
8-Piperidin-4-yl-1-oxa-8-azaspiro[4.5]decane
CID 117858909
N-[3-[3-(1-oxa-8-azaspiro[4.5]decan-3-ylamino)propoxy]propyl]-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 132212443
1-[5-[4-(Methylamino)piperidin-1-yl]hexan-2-yl]-3-(6-propan-2-ylmorpholin-3-yl)piperidin-4-amine
CID 134228334
N,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 135251256
2-(1-Azabicyclo[2.2.2]octan-2-ylmethoxy)ethanamine
CID 140344525
8-[6-(7-Azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane
CID 146587695
2-Methyl-6-[1-(1-piperidin-4-ylpiperidin-2-yl)ethyl]morpholine
CID 155095779
8-Propan-2-yl-6-oxa-9-azaspiro[4.5]decane;3-propan-2-yl-1-oxa-4,9-diazaspiro[5.5]undecane
CID 157858845

Frequently Asked Questions

What is the IUPAC name of 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane (CID 18525272) is 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane is C1CCN(C2CCN(C3COC4(CCNCC4)C3)CC2)CC1.
What is the InChIKey of 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is ZREJDHYRNJQOCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3O/c1-2-10-20(11-3-1)16-4-12-21(13-5-16)17-14-18(22-15-17)6-8-19-9-7-18/h16-17,19H,1-15H2.
What are the key properties of 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane?
3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 307.48 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-piperidin-1-ylpiperidin-1-yl)-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 18525272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).