6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one

C12H20N2O2 — CID 83257915

IUPAC6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
SMILESO=C1N(CCOC2CCCC2)CNC12CC2
InChIInChI=1S/C12H20N2O2/c15-11-12(5-6-12)13-9-14(11)7-8-16-10-3-1-2-4-10/h10,13H,1-9H2
InChIKeyZHILQJNYYZSZAM-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.87
Rot. Bonds4

About 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one

6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one (PubChem CID 83257915) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one.

Molecular Properties

Compound Name6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
PubChem CID83257915
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
SMILESO=C1N(CCOC2CCCC2)CNC12CC2
InChIInChI=1S/C12H20N2O2/c15-11-12(5-6-12)13-9-14(11)7-8-16-10-3-1-2-4-10/h10,13H,1-9H2
InChIKeyZHILQJNYYZSZAM-UHFFFAOYSA-N
XLogP0.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-Amino-2-ethoxypropyl)-5-ethyl-5-methylimidazolidine-2,4-dione
CID 63071985
1-(2-Cyclopentyloxyethyl)-3-(cyclopropylamino)pyrrolidin-2-one
CID 64239757
1-amino-N-(2-cyclopentyloxyethyl)cyclopropane-1-carboxamide
CID 65459772
6-(Oxolan-3-yl)-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 80260361
6-(2-Ethoxyethyl)-5-methyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83237480
6-(2-Ethoxyethyl)-5-(2-methylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83237487
6-(2-Ethoxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83237719
6-(2-Ethoxyethyl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83237735
5-Cyclopentyl-6-(2-ethoxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83237990
6-(2-Ethoxyethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83237991
6-(2-Ethoxyethyl)-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83238100
6-(1-Methoxypropan-2-yl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83238722

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one?
The IUPAC name of 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one (CID 83257915) is 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one.
What is the SMILES notation for 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one?
The canonical SMILES for 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one is O=C1N(CCOC2CCCC2)CNC12CC2.
What is the InChIKey of 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one?
The InChIKey is ZHILQJNYYZSZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c15-11-12(5-6-12)13-9-14(11)7-8-16-10-3-1-2-4-10/h10,13H,1-9H2.
What are the key properties of 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one?
6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one has a molecular weight of 224.30 g/mol, XLogP of 0.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one is sourced from PubChem (CID 83257915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).