8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one

C14H24N2O2 — CID 154571916

IUPAC8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCC1(C)CCC(N2CCC3(CC2)CNC(=O)O3)C1
InChIInChI=1S/C14H24N2O2/c1-13(2)4-3-11(9-13)16-7-5-14(6-8-16)10-15-12(17)18-14/h11H,3-10H2,1-2H3,(H,15,17)
InChIKeyCYRALXAHUMEPSP-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.14
Rot. Bonds1

About 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one

8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one (PubChem CID 154571916) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
PubChem CID154571916
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCC1(C)CCC(N2CCC3(CC2)CNC(=O)O3)C1
InChIInChI=1S/C14H24N2O2/c1-13(2)4-3-11(9-13)16-7-5-14(6-8-16)10-15-12(17)18-14/h11H,3-10H2,1-2H3,(H,15,17)
InChIKeyCYRALXAHUMEPSP-UHFFFAOYSA-N
XLogP2.14
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one (CID 154571916) is 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one is CC1(C)CCC(N2CCC3(CC2)CNC(=O)O3)C1.
What is the InChIKey of 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The InChIKey is CYRALXAHUMEPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-13(2)4-3-11(9-13)16-7-5-14(6-8-16)10-15-12(17)18-14/h11H,3-10H2,1-2H3,(H,15,17).
What are the key properties of 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one has a molecular weight of 252.36 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,3-dimethylcyclopentyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 154571916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).