(3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane

C9H17NO — CID 99933961

IUPAC(3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane
SMILESC[C@@H]1CC2(CCNCC2)CO1
InChIInChI=1S/C9H17NO/c1-8-6-9(7-11-8)2-4-10-5-3-9/h8,10H,2-7H2,1H3/t8-/m1/s1
InChIKeyCZWSYPBFOXGGAI-MRVPVSSYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds

About (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane

(3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane (PubChem CID 99933961) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name(3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane
PubChem CID99933961
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane
SMILESC[C@@H]1CC2(CCNCC2)CO1
InChIInChI=1S/C9H17NO/c1-8-6-9(7-11-8)2-4-10-5-3-9/h8,10H,2-7H2,1H3/t8-/m1/s1
InChIKeyCZWSYPBFOXGGAI-MRVPVSSYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane?
The IUPAC name of (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane (CID 99933961) is (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane is C[C@@H]1CC2(CCNCC2)CO1.
What is the InChIKey of (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane?
The InChIKey is CZWSYPBFOXGGAI-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8-6-9(7-11-8)2-4-10-5-3-9/h8,10H,2-7H2,1H3/t8-/m1/s1.
What are the key properties of (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane?
(3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane has a molecular weight of 155.24 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-2-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 99933961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).