2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one

C16H26N2O2 — CID 83267225

IUPAC2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one
SMILESO=C1N(C2CCOC2)C(C2CCCC2)NC12CCCC2
InChIInChI=1S/C16H26N2O2/c19-15-16(8-3-4-9-16)17-14(12-5-1-2-6-12)18(15)13-7-10-20-11-13/h12-14,17H,1-11H2
InChIKeyBAXBMJRJCJMCNF-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.04
Rot. Bonds2

About 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one

2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one (PubChem CID 83267225) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one
PubChem CID83267225
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one
SMILESO=C1N(C2CCOC2)C(C2CCCC2)NC12CCCC2
InChIInChI=1S/C16H26N2O2/c19-15-16(8-3-4-9-16)17-14(12-5-1-2-6-12)18(15)13-7-10-20-11-13/h12-14,17H,1-11H2
InChIKeyBAXBMJRJCJMCNF-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 16196749
[2-(Cyclopentylamino)-2-oxoethyl] 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetate
CID 7822085
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 2622801
[2-(Cyclopentylamino)-2-oxoethyl] 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate
CID 8286637
3-(2-Ethoxyethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 8522797
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 25363040
N-(3-butoxypropyl)-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetamide
CID 29857969
4-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(oxolan-2-ylmethyl)butanamide
CID 47008429
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 55520354
4-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-ethyl-N-(oxolan-3-ylmethyl)butanamide
CID 55744687
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(oxolan-2-ylmethyl)propanamide
CID 56809775
1-[2-(3-Methylbutoxy)ethyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 64218322

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one?
The IUPAC name of 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one (CID 83267225) is 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one.
What is the SMILES notation for 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one?
The canonical SMILES for 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one is O=C1N(C2CCOC2)C(C2CCCC2)NC12CCCC2.
What is the InChIKey of 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one?
The InChIKey is BAXBMJRJCJMCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c19-15-16(8-3-4-9-16)17-14(12-5-1-2-6-12)18(15)13-7-10-20-11-13/h12-14,17H,1-11H2.
What are the key properties of 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one?
2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one has a molecular weight of 278.40 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(oxolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one is sourced from PubChem (CID 83267225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).