3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane

C15H19Cl2NO2 — CID 102930132

IUPAC3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
SMILESClc1ccc(Cl)c(COC2COC3(CCNCC3)C2)c1
InChIInChI=1S/C15H19Cl2NO2/c16-12-1-2-14(17)11(7-12)9-19-13-8-15(20-10-13)3-5-18-6-4-15/h1-2,7,13,18H,3-6,8-10H2
InChIKeyZMRVYVUCGPCGOS-UHFFFAOYSA-N
MW316.23 g/mol
LogP3.42
Rot. Bonds3

About 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane

3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane (PubChem CID 102930132) has the molecular formula C15H19Cl2NO2 and a molecular weight of 316.23 g/mol. Its IUPAC name is 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
PubChem CID102930132
Molecular FormulaC15H19Cl2NO2
Molecular Weight316.23 g/mol
Exact Mass315.08
IUPAC Name3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
SMILESClc1ccc(Cl)c(COC2COC3(CCNCC3)C2)c1
InChIInChI=1S/C15H19Cl2NO2/c16-12-1-2-14(17)11(7-12)9-19-13-8-15(20-10-13)3-5-18-6-4-15/h1-2,7,13,18H,3-6,8-10H2
InChIKeyZMRVYVUCGPCGOS-UHFFFAOYSA-N
XLogP3.42
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.23
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-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

3-[(3-bromo-4-fluorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930076
3-[(4-methoxyphenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930200
3-[(4-chlorophenyl)methyl]-1-oxa-8-azaspiro[4.5]decane
CID 73439149
(3S)-3-[(2-methyl-1,3-thiazol-4-yl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 97394988
4-chloro-3-(oxetan-3-yloxymethyl)aniline
CID 102605525
3-[(4,5-dimethyl-1,3-thiazol-2-yl)methoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930090
3-[(E)-2,3-dichloroprop-2-enoxy]-1-oxa-8-azaspiro[4.5]decane
CID 102930085
4-phenylmethoxy-1-oxa-9-azaspiro[5.5]undecane
CID 86820394
(3S)-3-(4-fluorophenoxy)-1-oxa-8-azaspiro[4.5]decane
CID 124938709
3-[(2,5-dichlorophenyl)methoxy]-1-methylpyrrolidine
CID 143065328
3-(3,3-diethoxypropoxy)-1-oxa-8-azaspiro[4.5]decane
CID 102930291
5-chloro-2-(oxetan-3-yloxymethyl)aniline
CID 102605621

Frequently Asked Questions

What is the IUPAC name of 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane (CID 102930132) is 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane is Clc1ccc(Cl)c(COC2COC3(CCNCC3)C2)c1.
What is the InChIKey of 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is ZMRVYVUCGPCGOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Cl2NO2/c16-12-1-2-14(17)11(7-12)9-19-13-8-15(20-10-13)3-5-18-6-4-15/h1-2,7,13,18H,3-6,8-10H2.
What are the key properties of 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane?
3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 316.23 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,5-dichlorophenyl)methoxy]-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 102930132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).