(8R)-1,4-dioxaspiro[4.4]nonan-8-amine

C7H13NO2 — CID 95431886

IUPAC(8R)-1,4-dioxaspiro[4.4]nonan-8-amine
SMILESN[C@@H]1CCC2(C1)OCCO2
InChIInChI=1S/C7H13NO2/c8-6-1-2-7(5-6)9-3-4-10-7/h6H,1-5,8H2/t6-/m1/s1
InChIKeyFTUCRLHGAZBPBK-ZCFIWIBFSA-N
MW143.19 g/mol
LogP0.24
Rot. Bonds

About (8R)-1,4-dioxaspiro[4.4]nonan-8-amine

(8R)-1,4-dioxaspiro[4.4]nonan-8-amine (PubChem CID 95431886) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (8R)-1,4-dioxaspiro[4.4]nonan-8-amine.

Molecular Properties

Compound Name(8R)-1,4-dioxaspiro[4.4]nonan-8-amine
PubChem CID95431886
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(8R)-1,4-dioxaspiro[4.4]nonan-8-amine
SMILESN[C@@H]1CCC2(C1)OCCO2
InChIInChI=1S/C7H13NO2/c8-6-1-2-7(5-6)9-3-4-10-7/h6H,1-5,8H2/t6-/m1/s1
InChIKeyFTUCRLHGAZBPBK-ZCFIWIBFSA-N
XLogP0.24
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8R)-1,4-dioxaspiro[4.4]nonan-8-amine?
The IUPAC name of (8R)-1,4-dioxaspiro[4.4]nonan-8-amine (CID 95431886) is (8R)-1,4-dioxaspiro[4.4]nonan-8-amine.
What is the SMILES notation for (8R)-1,4-dioxaspiro[4.4]nonan-8-amine?
The canonical SMILES for (8R)-1,4-dioxaspiro[4.4]nonan-8-amine is N[C@@H]1CCC2(C1)OCCO2.
What is the InChIKey of (8R)-1,4-dioxaspiro[4.4]nonan-8-amine?
The InChIKey is FTUCRLHGAZBPBK-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H13NO2/c8-6-1-2-7(5-6)9-3-4-10-7/h6H,1-5,8H2/t6-/m1/s1.
What are the key properties of (8R)-1,4-dioxaspiro[4.4]nonan-8-amine?
(8R)-1,4-dioxaspiro[4.4]nonan-8-amine has a molecular weight of 143.19 g/mol, XLogP of 0.24, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-1,4-dioxaspiro[4.4]nonan-8-amine is sourced from PubChem (CID 95431886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).