3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione

C15H24N2O2 — CID 63252503

IUPAC3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione
SMILESNC1CCCC1N1C(=O)CC2(CCCCC2)CC1=O
InChIInChI=1S/C15H24N2O2/c16-11-5-4-6-12(11)17-13(18)9-15(10-14(17)19)7-2-1-3-8-15/h11-12H,1-10,16H2
InChIKeyNBKFOFZNLNUCOJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.97
Rot. Bonds1

About 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione

3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione (PubChem CID 63252503) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione.

Molecular Properties

Compound Name3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione
PubChem CID63252503
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione
SMILESNC1CCCC1N1C(=O)CC2(CCCCC2)CC1=O
InChIInChI=1S/C15H24N2O2/c16-11-5-4-6-12(11)17-13(18)9-15(10-14(17)19)7-2-1-3-8-15/h11-12H,1-10,16H2
InChIKeyNBKFOFZNLNUCOJ-UHFFFAOYSA-N
XLogP1.97
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione?
The IUPAC name of 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione (CID 63252503) is 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione.
What is the SMILES notation for 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione?
The canonical SMILES for 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione is NC1CCCC1N1C(=O)CC2(CCCCC2)CC1=O.
What is the InChIKey of 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione?
The InChIKey is NBKFOFZNLNUCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c16-11-5-4-6-12(11)17-13(18)9-15(10-14(17)19)7-2-1-3-8-15/h11-12H,1-10,16H2.
What are the key properties of 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione?
3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione has a molecular weight of 264.37 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione is sourced from PubChem (CID 63252503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).