11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane

C17H32N2O3 — CID 134072746

IUPAC11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESCOCCN1CCOCC2(CCCN(CC3CCOC3)C2)C1
InChIInChI=1S/C17H32N2O3/c1-20-9-6-18-7-10-22-15-17(13-18)4-2-5-19(14-17)11-16-3-8-21-12-16/h16H,2-15H2,1H3
InChIKeyRGIWIPHTNDFVBV-UHFFFAOYSA-N
MW312.45 g/mol
LogP1.08
Rot. Bonds5

About 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane

11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane (PubChem CID 134072746) has the molecular formula C17H32N2O3 and a molecular weight of 312.45 g/mol. Its IUPAC name is 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
PubChem CID134072746
Molecular FormulaC17H32N2O3
Molecular Weight312.45 g/mol
Exact Mass312.24
IUPAC Name11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESCOCCN1CCOCC2(CCCN(CC3CCOC3)C2)C1
InChIInChI=1S/C17H32N2O3/c1-20-9-6-18-7-10-22-15-17(13-18)4-2-5-19(14-17)11-16-3-8-21-12-16/h16H,2-15H2,1H3
InChIKeyRGIWIPHTNDFVBV-UHFFFAOYSA-N
XLogP1.08
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.45
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane with MolForge

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Related Compounds

2-(oxolan-3-ylmethyl)-2,8-diazaspiro[5.5]undecane
CID 102849336
3-methyl-1-(oxolan-3-ylmethyl)piperidin-3-ol
CID 115873758
1-[(5R)-9-[[(3R)-oxolan-3-yl]methyl]-2,9-diazaspiro[4.5]decan-2-yl]ethanone
CID 98783278
[11-(2-methoxyethyl)-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]-thiophen-3-ylmethanone
CID 131661217
(5S)-10-ethylsulfonyl-2-(2-methoxyethyl)-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97406862
(5S)-2-(2-methoxyethyl)-10-(2-phenylethyl)-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97472054
1-(oxolan-3-ylmethyl)pyrrolidine
CID 66580688
(5S)-10-(furan-3-ylmethyl)-2-(2-methoxyethyl)-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97384827
11-(cyclopropylmethyl)-2-pyrimidin-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 118743550
11-(2-methoxyethyl)-2-(1,3-thiazol-2-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane;bis(2,2,2-trifluoroacetic acid)
CID 155838289
1-[(6S)-8-[[(3S)-oxolan-3-yl]methyl]-1-oxa-4,8-diazaspiro[5.5]undecan-4-yl]ethanone
CID 124522552
(6R)-11-(cyclopropylmethyl)-2-(thiophen-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 97372753

Frequently Asked Questions

What is the IUPAC name of 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane (CID 134072746) is 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane is COCCN1CCOCC2(CCCN(CC3CCOC3)C2)C1.
What is the InChIKey of 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The InChIKey is RGIWIPHTNDFVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O3/c1-20-9-6-18-7-10-22-15-17(13-18)4-2-5-19(14-17)11-16-3-8-21-12-16/h16H,2-15H2,1H3.
What are the key properties of 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane has a molecular weight of 312.45 g/mol, XLogP of 1.08, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(2-methoxyethyl)-2-(oxolan-3-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 134072746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).