2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane

C14H23NO2 — CID 79670497

IUPAC2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane
SMILESC1CC2(C1)CN(C1CCC3(CC1)OCCO3)C2
InChIInChI=1S/C14H23NO2/c1-4-13(5-1)10-15(11-13)12-2-6-14(7-3-12)16-8-9-17-14/h12H,1-11H2
InChIKeyKQGKQRIIQFDNNI-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.16
Rot. Bonds1

About 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane

2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane (PubChem CID 79670497) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane
PubChem CID79670497
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane
SMILESC1CC2(C1)CN(C1CCC3(CC1)OCCO3)C2
InChIInChI=1S/C14H23NO2/c1-4-13(5-1)10-15(11-13)12-2-6-14(7-3-12)16-8-9-17-14/h12H,1-11H2
InChIKeyKQGKQRIIQFDNNI-UHFFFAOYSA-N
XLogP2.16
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-4-(1,4-dioxaspiro[4.5]decan-8-yl)piperazine
CID 131872684
1-(1,4-dioxaspiro[4.5]decan-8-yl)-3,3-dipropylazetidine
CID 79670328
1-(1,4-dioxaspiro[4.5]decan-8-yl)-3-methylazetidine
CID 79672192
1-(azetidin-3-yl)-4-(1,4-dioxaspiro[4.5]decan-8-yl)piperazine
CID 66204059
4-(2-azaspiro[3.3]heptan-2-yl)cyclohexan-1-ol
CID 104549132
8,11-dioxadispiro[3.2.47.24]tridecane
CID 171769026
1-[1-(1,4-dioxaspiro[4.5]decan-8-yl)pyrrolidin-3-yl]-N-methylmethanamine
CID 63263214
2-(1,4-dioxaspiro[4.5]decan-8-yl)thiazinane 1,1-dioxide
CID 116816854
1-[4-(1,4-dioxaspiro[4.5]decan-8-yl)morpholin-2-yl]ethanamine
CID 115315072
8-(oxan-3-yl)-1,4-dioxa-8-azaspiro[4.5]decane
CID 103738480
2-piperidin-3-yl-2-azaspiro[3.3]heptane
CID 79677674
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2,5-dimethylpyrrol-1-amine
CID 79100157

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane?
The IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane (CID 79670497) is 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane.
What is the SMILES notation for 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane?
The canonical SMILES for 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane is C1CC2(C1)CN(C1CCC3(CC1)OCCO3)C2.
What is the InChIKey of 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane?
The InChIKey is KQGKQRIIQFDNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-4-13(5-1)10-15(11-13)12-2-6-14(7-3-12)16-8-9-17-14/h12H,1-11H2.
What are the key properties of 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane?
2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane has a molecular weight of 237.34 g/mol, XLogP of 2.16, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dioxaspiro[4.5]decan-8-yl)-2-azaspiro[3.3]heptane is sourced from PubChem (CID 79670497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).