9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane

C17H25NO3 — CID 134071298

IUPAC9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane
SMILESCOCCN1CCCC2(CC(Oc3ccccc3)CO2)C1
InChIInChI=1S/C17H25NO3/c1-19-11-10-18-9-5-8-17(14-18)12-16(13-20-17)21-15-6-3-2-4-7-15/h2-4,6-7,16H,5,8-14H2,1H3
InChIKeySWQZBRYRWBSFKM-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.34
Rot. Bonds5

About 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane

9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane (PubChem CID 134071298) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane.

Molecular Properties

Compound Name9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane
PubChem CID134071298
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane
SMILESCOCCN1CCCC2(CC(Oc3ccccc3)CO2)C1
InChIInChI=1S/C17H25NO3/c1-19-11-10-18-9-5-8-17(14-18)12-16(13-20-17)21-15-6-3-2-4-7-15/h2-4,6-7,16H,5,8-14H2,1H3
InChIKeySWQZBRYRWBSFKM-UHFFFAOYSA-N
XLogP2.34
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenoxy-7-(2-phenylethyl)-1-oxa-7-azaspiro[4.4]nonane
CID 134071068
8-(2-methoxyethyl)-3-pyridin-3-yloxy-1-oxa-8-azaspiro[4.5]decane
CID 134071228
(3S)-8-(cyclobutylmethyl)-3-phenoxy-1-oxa-8-azaspiro[4.5]decane
CID 97488488
8-(2-methoxyethyl)-3-phenylmethoxy-1-oxa-8-azaspiro[4.5]decane
CID 134074923
(3S,5R)-9-(cyclopropylmethyl)-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decane
CID 97371627
9-(cyclobutylmethyl)-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decane
CID 134071300
7-[(2-methoxy-3-pyridinyl)methyl]-3-phenoxy-1-oxa-7-azaspiro[4.4]nonane
CID 134071071
(3S,5S)-9-[(5-methylfuran-2-yl)methyl]-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decane
CID 124519886
(3S,5R)-3-methyl-9-(2-phenylethyl)-1-oxa-9-azaspiro[4.5]decane
CID 97395102
(3S,5R)-9-[(4-fluorophenyl)methyl]-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decane
CID 124519890
(3S,5S)-9-(furan-2-ylmethyl)-3-pyridin-3-yloxy-1-oxa-9-azaspiro[4.5]decane
CID 97488993
(3S,5S)-3-phenoxy-7-(thiadiazol-4-ylmethyl)-1-oxa-7-azaspiro[4.4]nonane
CID 97394368

Frequently Asked Questions

What is the IUPAC name of 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane?
The IUPAC name of 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane (CID 134071298) is 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane.
What is the SMILES notation for 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane?
The canonical SMILES for 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane is COCCN1CCCC2(CC(Oc3ccccc3)CO2)C1.
What is the InChIKey of 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane?
The InChIKey is SWQZBRYRWBSFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-19-11-10-18-9-5-8-17(14-18)12-16(13-20-17)21-15-6-3-2-4-7-15/h2-4,6-7,16H,5,8-14H2,1H3.
What are the key properties of 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane?
9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane has a molecular weight of 291.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methoxyethyl)-3-phenoxy-1-oxa-9-azaspiro[4.5]decane is sourced from PubChem (CID 134071298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).