8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane

C23H39N3O — CID 146587695

IUPAC8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane
SMILESC1COC2(C1)CCN(C1CC13CCN(C1CCC14CCNCC4)CC3)CC2
InChIInChI=1S/C23H39N3O/c1-3-23(27-17-1)9-15-26(16-10-23)20-18-22(20)7-13-25(14-8-22)19-2-4-21(19)5-11-24-12-6-21/h19-20,24H,1-18H2
InChIKeyRREMWFPQMYGHLO-UHFFFAOYSA-N
MW373.59 g/mol
LogP3.02
Rot. Bonds2

About 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane

8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane (PubChem CID 146587695) has the molecular formula C23H39N3O and a molecular weight of 373.59 g/mol. Its IUPAC name is 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane
PubChem CID146587695
Molecular FormulaC23H39N3O
Molecular Weight373.59 g/mol
Exact Mass373.31
IUPAC Name8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane
SMILESC1COC2(C1)CCN(C1CC13CCN(C1CCC14CCNCC4)CC3)CC2
InChIInChI=1S/C23H39N3O/c1-3-23(27-17-1)9-15-26(16-10-23)20-18-22(20)7-13-25(14-8-22)19-2-4-21(19)5-11-24-12-6-21/h19-20,24H,1-18H2
InChIKeyRREMWFPQMYGHLO-UHFFFAOYSA-N
XLogP3.02
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.59
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 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) is 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane is C1COC2(C1)CCN(C1CC13CCN(C1CCC14CCNCC4)CC3)CC2.
What is the InChIKey of 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is RREMWFPQMYGHLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H39N3O/c1-3-23(27-17-1)9-15-26(16-10-23)20-18-22(20)7-13-25(14-8-22)19-2-4-21(19)5-11-24-12-6-21/h19-20,24H,1-18H2.
What are the key properties of 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane?
8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 373.59 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-(7-azaspiro[3.5]nonan-3-yl)-6-azaspiro[2.5]octan-2-yl]-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 146587695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).