2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone

C15H28N2O4 — CID 97491871

IUPAC2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone
SMILESCCOCC(=O)N1CCC2(CC1)COCCN2CCOC
InChIInChI=1S/C15H28N2O4/c1-3-20-12-14(18)16-6-4-15(5-7-16)13-21-11-9-17(15)8-10-19-2/h3-13H2,1-2H3
InChIKeyIPOYIWBUQMOCQL-UHFFFAOYSA-N
MW300.40 g/mol
LogP0.36
Rot. Bonds6

About 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone

2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone (PubChem CID 97491871) has the molecular formula C15H28N2O4 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone.

Molecular Properties

Compound Name2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone
PubChem CID97491871
Molecular FormulaC15H28N2O4
Molecular Weight300.40 g/mol
Exact Mass300.20
IUPAC Name2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone
SMILESCCOCC(=O)N1CCC2(CC1)COCCN2CCOC
InChIInChI=1S/C15H28N2O4/c1-3-20-12-14(18)16-6-4-15(5-7-16)13-21-11-9-17(15)8-10-19-2/h3-13H2,1-2H3
InChIKeyIPOYIWBUQMOCQL-UHFFFAOYSA-N
XLogP0.36
TPSA51.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 50.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-[2-(Dimethylamino)ethyl]-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]-2-methoxyethanone
CID 97491891
1-[1-[2-(Dimethylamino)ethyl]-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]-2-ethoxyethanone
CID 97491892
1-[1-[2-(Dimethylamino)ethyl]-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone
CID 97491893
1,9-Dimethyl-4-[(2,2,3,3-tetrafluoropropoxy)acetyl]-1,4,9-triazaspiro[5.5]undecane
CID 56746732
2-Ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone;2,2,2-trifluoroacetic acid
CID 118743034
9-(Methoxyacetyl)-1-methyl-4-(tetrahydrofuran-3-ylmethyl)-1,4,9-triazaspiro[5.5]undecane
CID 56742423
9-(Butoxyacetyl)-1,4-dimethyl-1,4,9-triazaspiro[5.5]undecane
CID 56746776
1-[1-[2-(Dimethylamino)ethyl]-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]-2-methylpropan-1-one
CID 97409230
5-Methyl-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)morpholin-3-one
CID 18552195
4,9-Dimethyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 22975638
4-(3-Oxomorpholin-4-yl)-1-propan-2-ylpiperidine-4-carbonitrile
CID 22980196
4-(1-Propan-2-ylpiperidin-4-yl)morpholin-3-one
CID 22980209

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone?
The IUPAC name of 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone (CID 97491871) is 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone.
What is the SMILES notation for 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone?
The canonical SMILES for 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone is CCOCC(=O)N1CCC2(CC1)COCCN2CCOC.
What is the InChIKey of 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone?
The InChIKey is IPOYIWBUQMOCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O4/c1-3-20-12-14(18)16-6-4-15(5-7-16)13-21-11-9-17(15)8-10-19-2/h3-13H2,1-2H3.
What are the key properties of 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone?
2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone has a molecular weight of 300.40 g/mol, XLogP of 0.36, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-[1-(2-methoxyethyl)-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]ethanone is sourced from PubChem (CID 97491871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).