3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane

C16H23NO3 — CID 102930200

IUPAC3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
SMILESCOc1ccc(COC2COC3(CCNCC3)C2)cc1
InChIInChI=1S/C16H23NO3/c1-18-14-4-2-13(3-5-14)11-19-15-10-16(20-12-15)6-8-17-9-7-16/h2-5,15,17H,6-12H2,1H3
InChIKeyINUCVLMDBPAQPH-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.12
Rot. Bonds4

About 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane

3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane (PubChem CID 102930200) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
PubChem CID102930200
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
SMILESCOc1ccc(COC2COC3(CCNCC3)C2)cc1
InChIInChI=1S/C16H23NO3/c1-18-14-4-2-13(3-5-14)11-19-15-10-16(20-12-15)6-8-17-9-7-16/h2-5,15,17H,6-12H2,1H3
InChIKeyINUCVLMDBPAQPH-UHFFFAOYSA-N
XLogP2.12
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3-bromo-4-fluorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930076
4-phenylmethoxy-1-oxa-9-azaspiro[5.5]undecane
CID 86820394
(3S)-3-[(2-methyl-1,3-thiazol-4-yl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 97394988
3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930602
3-[(4,5-dimethyl-1,3-thiazol-2-yl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930090
3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930132
(3S)-3-(4-fluorophenoxy)-1-oxa-8-azaspiro[4.5]decane
CID 124938709
3-[(E)-2,3-dichloroprop-2-enoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930085
3-[(6-methyl-2-pyridinyl)oxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930458
8-(2-methoxyethyl)-3-phenylmethoxy-1-oxa-8-azaspiro[4.5]decane
CID 134074923
(1R,4S,5S)-5-[(4-methoxyphenyl)methoxy]-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane
CID 100964570
3-[(4-methoxyphenyl)methoxy]-1-methylazetidine
CID 20517347

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane (CID 102930200) is 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane is COc1ccc(COC2COC3(CCNCC3)C2)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is INUCVLMDBPAQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-18-14-4-2-13(3-5-14)11-19-15-10-16(20-12-15)6-8-17-9-7-16/h2-5,15,17H,6-12H2,1H3.
What are the key properties of 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 277.36 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 102930200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).