3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane

C15H21NO3 — CID 82024495

IUPAC3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane
SMILESCCOc1ccccc1C1COC2(CCNCC2)O1
InChIInChI=1S/C15H21NO3/c1-2-17-13-6-4-3-5-12(13)14-11-18-15(19-14)7-9-16-10-8-15/h3-6,14,16H,2,7-11H2,1H3
InChIKeyCLFDSXQBANBFEQ-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.25
Rot. Bonds3

About 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane

3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane (PubChem CID 82024495) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane
PubChem CID82024495
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane
SMILESCCOc1ccccc1C1COC2(CCNCC2)O1
InChIInChI=1S/C15H21NO3/c1-2-17-13-6-4-3-5-12(13)14-11-18-15(19-14)7-9-16-10-8-15/h3-6,14,16H,2,7-11H2,1H3
InChIKeyCLFDSXQBANBFEQ-UHFFFAOYSA-N
XLogP2.25
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2-ethoxyphenyl)-2,2-dimethyl-1,3-oxazolidine
CID 82286548
3-(4-chlorophenyl)-1,4-dioxa-8-azaspiro[4.5]decane
CID 82024492
(2R)-2-(2-ethoxyphenyl)azetidine
CID 131015812
(3R)-3-(2-ethoxyphenyl)morpholine
CID 42183310
2-(2-ethoxyphenyl)-4,4-dimethyl-1,3-oxazolidine
CID 82114526
4-(2-ethoxyphenyl)-3-methylpiperidine
CID 66280150
1-(2-ethoxyphenyl)-2,2-dimethyl-1,5-diazocane
CID 117014837
3-acetyl-5-(2-ethoxyphenyl)oxolan-2-one
CID 82131092
2-[2-(2-ethoxyphenyl)-1,3-dioxolan-4-yl]acetonitrile
CID 82128978
(4S)-2-(2-ethoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104949924
2-(2-ethoxyphenyl)-2,3-dihydropyran-4-one
CID 15445237
ethyl 4-(1,4-dioxaspiro[4.5]decan-3-yl)-2-methyl-6-phenylpyridine-3-carboxylate
CID 155557593

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane?
The IUPAC name of 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane (CID 82024495) is 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane?
The canonical SMILES for 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane is CCOc1ccccc1C1COC2(CCNCC2)O1.
What is the InChIKey of 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane?
The InChIKey is CLFDSXQBANBFEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-2-17-13-6-4-3-5-12(13)14-11-18-15(19-14)7-9-16-10-8-15/h3-6,14,16H,2,7-11H2,1H3.
What are the key properties of 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane?
3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane has a molecular weight of 263.34 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 82024495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).