(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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Related Compounds

(4'aR,8'aS)-spiro[1,3-dioxolane-2,6'-2,3,4,4a,5,7,8,8a-octahydro-1H-naphthalene]-2'-amine
CID 10013382
7-amino-1,4-dioxaspiro[4.5]decan-8-ol
CID 76655508
(8S)-8-(iodomethyl)-1,4-dioxaspiro[4.4]nonane
CID 67237087
spiro[1,3-dioxolane-2,3'-7-oxabicyclo[4.1.0]heptane]
CID 13062431
(7R,8S)-8-amino-1,4-dioxaspiro[4.5]decane-7-carboxylic acid
CID 87436012
(8S)-1,4-dioxaspiro[4.4]nonane-8-carboxamide
CID 158487306
(5R,8S)-1-oxaspiro[4.4]nonan-8-amine
CID 99996100
7-(2-cyclopropylethoxy)-1,4-dioxaspiro[4.5]decan-8-amine
CID 106200696
7-(4,4-dimethylpiperidin-1-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 55156891
8-(cyclopropylmethyl)-1,4-dioxaspiro[4.5]decane
CID 58749727
spiro[1,2,3,3a,4,5,7,7a-octahydroisoindole-6,2'-1,3-dioxolane]
CID 149093719
(7S,8R)-7,8-di(propan-2-yl)-1,4-dioxaspiro[4.5]decane
CID 121421967

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).