2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione

C14H22N2O2 — CID 43653779

IUPAC2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione
SMILESNC1CCC(N2C(=O)CC3(CCCC3)C2=O)CC1
InChIInChI=1S/C14H22N2O2/c15-10-3-5-11(6-4-10)16-12(17)9-14(13(16)18)7-1-2-8-14/h10-11H,1-9,15H2
InChIKeyIYBNYRIFBMLBGO-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.58
Rot. Bonds1

About 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione

2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione (PubChem CID 43653779) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione.

Molecular Properties

Compound Name2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione
PubChem CID43653779
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione
SMILESNC1CCC(N2C(=O)CC3(CCCC3)C2=O)CC1
InChIInChI=1S/C14H22N2O2/c15-10-3-5-11(6-4-10)16-12(17)9-14(13(16)18)7-1-2-8-14/h10-11H,1-9,15H2
InChIKeyIYBNYRIFBMLBGO-UHFFFAOYSA-N
XLogP1.58
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

2-(4-oxocyclohexyl)-2-azaspiro[4.6]undecane-1,3-dione
CID 79672322
2-(2-aminocyclopentyl)-2-azaspiro[4.6]undecane-1,3-dione
CID 55167605
2-(5-azaspiro[3.5]nonan-8-yl)-2-azaspiro[4.4]nonane-1,3-dione
CID 61350736
4-(4-aminocyclohexyl)thiomorpholine-3,5-dione
CID 104570981
3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione
CID 125489474
2-(2-oxo-1-prop-2-enylpyrrolidin-3-yl)-2-azaspiro[4.5]decane-1,3-dione
CID 166202054
4-cyclopentyl-2,4-diazaspiro[5.5]undecane-3,5-dione
CID 113309795
2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione
CID 10563768
2-(pyrrolidin-3-ylmethyl)-2-azaspiro[4.4]nonane-1,3-dione
CID 80564107
2-[(3-hydroxycyclopentyl)methyl]-2-azaspiro[4.4]nonane-1,3-dione
CID 106131148
2-[(E)-4-aminobut-2-enyl]-2-azaspiro[4.6]undecane-1,3-dione
CID 113414932
8-cyclobutyl-6,8-diazaspiro[4.5]decane-7,9-dione
CID 116658436

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione?
The IUPAC name of 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione (CID 43653779) is 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione.
What is the SMILES notation for 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione?
The canonical SMILES for 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione is NC1CCC(N2C(=O)CC3(CCCC3)C2=O)CC1.
What is the InChIKey of 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione?
The InChIKey is IYBNYRIFBMLBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c15-10-3-5-11(6-4-10)16-12(17)9-14(13(16)18)7-1-2-8-14/h10-11H,1-9,15H2.
What are the key properties of 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione?
2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione has a molecular weight of 250.34 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminocyclohexyl)-2-azaspiro[4.4]nonane-1,3-dione is sourced from PubChem (CID 43653779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).