4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane

C17H27NO3 — CID 131678473

IUPAC4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane
SMILESCCOCCC1CCOC12CCN(Cc1ccoc1)CC2
InChIInChI=1S/C17H27NO3/c1-2-19-11-4-16-5-12-21-17(16)6-8-18(9-7-17)13-15-3-10-20-14-15/h3,10,14,16H,2,4-9,11-13H2,1H3
InChIKeyWZTQUGOLEUZFIO-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.08
Rot. Bonds6

About 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane

4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane (PubChem CID 131678473) has the molecular formula C17H27NO3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane
PubChem CID131678473
Molecular FormulaC17H27NO3
Molecular Weight293.41 g/mol
Exact Mass293.20
IUPAC Name4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane
SMILESCCOCCC1CCOC12CCN(Cc1ccoc1)CC2
InChIInChI=1S/C17H27NO3/c1-2-19-11-4-16-5-12-21-17(16)6-8-18(9-7-17)13-15-3-10-20-14-15/h3,10,14,16H,2,4-9,11-13H2,1H3
InChIKeyWZTQUGOLEUZFIO-UHFFFAOYSA-N
XLogP3.08
TPSA34.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(2-ethoxyethyl)-8-(pyridin-4-ylmethyl)-1-oxa-8-azaspiro[4.5]decane
CID 133141822
[4-(2-ethoxyethyl)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methylfuran-2-yl)methanone
CID 131641705
(4R)-8-(2-chlorophenyl)sulfonyl-4-(2-ethoxyethyl)-1-oxa-8-azaspiro[4.5]decane
CID 124870257
4-[2-(pyridin-2-ylmethoxy)ethyl]-8-(pyridin-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane
CID 131658499
N,N-dimethyl-2-[2-[8-(pyridin-2-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-4-yl]ethoxy]acetamide
CID 131677276
8-[(1-ethylpyrazol-4-yl)methyl]-4-(2-pyridin-2-yloxyethyl)-1-oxa-8-azaspiro[4.5]decane
CID 131649042
(3R)-8-(furan-3-ylmethyl)-N,N-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 97371272
(3-chloro-4-fluorophenyl)-[(4R)-4-(2-ethoxyethyl)-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 124870354
[(4R)-4-(2-ethoxyethyl)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-fluoro-4-methoxyphenyl)methanone
CID 124821118
1-[(4R)-4-(2-ethoxyethyl)-1-oxa-8-azaspiro[4.5]decan-8-yl]-2-(4-fluoro-2-methoxyphenyl)ethanone
CID 124799575
4-(2-methoxyethyl)-8-(pyridin-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 155859647
N-[2-[(8S)-2-(furan-3-ylmethyl)-5-oxa-2-azaspiro[3.4]octan-8-yl]ethyl]-5-methylpyrimidin-2-amine
CID 124912819

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane (CID 131678473) is 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane is CCOCCC1CCOC12CCN(Cc1ccoc1)CC2.
What is the InChIKey of 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is WZTQUGOLEUZFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO3/c1-2-19-11-4-16-5-12-21-17(16)6-8-18(9-7-17)13-15-3-10-20-14-15/h3,10,14,16H,2,4-9,11-13H2,1H3.
What are the key properties of 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane?
4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 293.41 g/mol, XLogP of 3.08, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyethyl)-8-(furan-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 131678473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).