1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone

C15H25NO4 — CID 103163779

IUPAC1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone
SMILESCCOC1CC(CC(=O)N2CCCC3(C2)OCCO3)C1
InChIInChI=1S/C15H25NO4/c1-2-18-13-8-12(9-13)10-14(17)16-5-3-4-15(11-16)19-6-7-20-15/h12-13H,2-11H2,1H3
InChIKeyPNIUWQIWQLUKIL-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.56
Rot. Bonds4

About 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone

1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone (PubChem CID 103163779) has the molecular formula C15H25NO4 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone.

Molecular Properties

Compound Name1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone
PubChem CID103163779
Molecular FormulaC15H25NO4
Molecular Weight283.37 g/mol
Exact Mass283.18
IUPAC Name1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone
SMILESCCOC1CC(CC(=O)N2CCCC3(C2)OCCO3)C1
InChIInChI=1S/C15H25NO4/c1-2-18-13-8-12(9-13)10-14(17)16-5-3-4-15(11-16)19-6-7-20-15/h12-13H,2-11H2,1H3
InChIKeyPNIUWQIWQLUKIL-UHFFFAOYSA-N
XLogP1.56
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone with MolForge

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Related Compounds

1,4-Dioxa-9-azaspiro[4.5]decan-9-yl-(3-methyloxolan-2-yl)methanone
CID 81722678
1-(1,4-Dioxa-9-azaspiro[4.5]decan-9-yl)-2-ethylhexan-1-one
CID 81722766
1,4-Dioxa-9-azaspiro[4.5]decan-9-yl-(5-methyloxolan-2-yl)methanone
CID 81722772
1-(1,4-Dioxa-8-azaspiro[4.5]decan-8-yl)-2-(3-ethoxycyclobutyl)ethanone
CID 103163778
2-(3-Ethoxycyclobutyl)-1-morpholin-4-ylethanone
CID 103164591
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-2-(3-ethoxycyclobutyl)acetamide
CID 103279656
2-Cyclobutyl-1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)ethanone
CID 103860787
1,4-Dioxaspiro[4.5]decan-8-yl(morpholin-4-yl)methanone
CID 112530550
1-(1,4-Dioxa-9-azaspiro[4.5]decan-9-yl)-2-(1-methoxycyclobutyl)ethanone
CID 113826061

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone?
The IUPAC name of 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone (CID 103163779) is 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone.
What is the SMILES notation for 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone?
The canonical SMILES for 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone is CCOC1CC(CC(=O)N2CCCC3(C2)OCCO3)C1.
What is the InChIKey of 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone?
The InChIKey is PNIUWQIWQLUKIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c1-2-18-13-8-12(9-13)10-14(17)16-5-3-4-15(11-16)19-6-7-20-15/h12-13H,2-11H2,1H3.
What are the key properties of 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone?
1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone has a molecular weight of 283.37 g/mol, XLogP of 1.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone is sourced from PubChem (CID 103163779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).