1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine

C13H21NO2 — CID 11287514

IUPAC1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine
SMILESC1=C(N2CCCCC2)CCC2(C1)OCCO2
InChIInChI=1S/C13H21NO2/c1-2-8-14(9-3-1)12-4-6-13(7-5-12)15-10-11-16-13/h4H,1-3,5-11H2
InChIKeyXVHIFMYKLAUXKF-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.28
Rot. Bonds1

About 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine

1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine (PubChem CID 11287514) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine.

Molecular Properties

Compound Name1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine
PubChem CID11287514
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine
SMILESC1=C(N2CCCCC2)CCC2(C1)OCCO2
InChIInChI=1S/C13H21NO2/c1-2-8-14(9-3-1)12-4-6-13(7-5-12)15-10-11-16-13/h4H,1-3,5-11H2
InChIKeyXVHIFMYKLAUXKF-UHFFFAOYSA-N
XLogP2.28
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-dioxaspiro[4.5]dec-7-ene-8-thiol
CID 141171889
8-(trifluoromethyl)-1,4-dioxaspiro[4.5]dec-7-ene
CID 90858366
1,4-dioxaspiro[4.5]dec-7-ene-8-carbaldehyde
CID 14753677
1-(cyclohepten-1-yl)pyrrolidine
CID 586037
ethane;8-ethyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 144926160
8-propa-1,2-dienyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 86086253
ethane;8-phenyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 91004379
8-prop-2-enyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 13213608
5-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-1,2-dihydropyridine
CID 141283297
8-but-3-enyl-1,4-dioxaspiro[4.5]dec-7-ene
CID 71344896
(1R)-1-methyl-4-morpholin-4-ylcyclohex-3-ene-1-carboxylic acid
CID 124650181
1-[4-(1,4-dioxaspiro[4.5]decan-8-yl)phenyl]pyrrolidine
CID 59541880

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine?
The IUPAC name of 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine (CID 11287514) is 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine.
What is the SMILES notation for 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine?
The canonical SMILES for 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine is C1=C(N2CCCCC2)CCC2(C1)OCCO2.
What is the InChIKey of 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine?
The InChIKey is XVHIFMYKLAUXKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-8-14(9-3-1)12-4-6-13(7-5-12)15-10-11-16-13/h4H,1-3,5-11H2.
What are the key properties of 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine?
1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine has a molecular weight of 223.32 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)piperidine is sourced from PubChem (CID 11287514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).