3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one

C14H24N2O — CID 114552438

IUPAC3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one
SMILESCC1(C)CCC(N2CNC3(CCCC3)C2=O)C1
InChIInChI=1S/C14H24N2O/c1-13(2)8-5-11(9-13)16-10-15-14(12(16)17)6-3-4-7-14/h11,15H,3-10H2,1-2H3
InChIKeyXGHNGZBEKMEWDS-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.27
Rot. Bonds1

About 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one

3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one (PubChem CID 114552438) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one.

Molecular Properties

Compound Name3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one
PubChem CID114552438
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one
SMILESCC1(C)CCC(N2CNC3(CCCC3)C2=O)C1
InChIInChI=1S/C14H24N2O/c1-13(2)8-5-11(9-13)16-10-15-14(12(16)17)6-3-4-7-14/h11,15H,3-10H2,1-2H3
InChIKeyXGHNGZBEKMEWDS-UHFFFAOYSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(3,3-dimethylcyclopentyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 114552420
3-(3,5-dimethylcyclohexyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83258739
3-(3,3-dimethylcyclopentyl)-5-methylimidazolidin-4-one
CID 114552415
6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83260104
3-(3,3-dimethylcyclopentyl)-5-phenylimidazolidin-4-one
CID 114552517
6-(1-ethylpiperidin-3-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83245860
6-(2-methylcycloheptyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83258358
3-bromo-1-(3,3-dimethylcyclopentyl)piperidin-2-one
CID 114541337
1-(3,3-dimethylcyclopentyl)-3-phenylpiperazine-2,5-dione
CID 114551374
1-(4,4-dimethylcyclohexyl)pyrrolidin-2-one
CID 130233518
3-(3,3-dimethylcyclohexyl)-2-propyl-1,3-diazaspiro[4.4]nonan-4-one
CID 83268080
9-(4,4-dimethylcyclohexyl)-7,9-diazaspiro[4.5]decane-6,8,10-trione
CID 115948526

Frequently Asked Questions

What is the IUPAC name of 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one?
The IUPAC name of 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one (CID 114552438) is 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one.
What is the SMILES notation for 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one?
The canonical SMILES for 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one is CC1(C)CCC(N2CNC3(CCCC3)C2=O)C1.
What is the InChIKey of 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one?
The InChIKey is XGHNGZBEKMEWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-13(2)8-5-11(9-13)16-10-15-14(12(16)17)6-3-4-7-14/h11,15H,3-10H2,1-2H3.
What are the key properties of 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one?
3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one has a molecular weight of 236.36 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one is sourced from PubChem (CID 114552438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).