2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine

C14H20ClNO2 — CID 55060618

IUPAC2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine
SMILESCOc1ccc(Cl)cc1COCC1CCCCN1
InChIInChI=1S/C14H20ClNO2/c1-17-14-6-5-12(15)8-11(14)9-18-10-13-4-2-3-7-16-13/h5-6,8,13,16H,2-4,7,9-10H2,1H3
InChIKeyNJCTUJSZKROMJB-UHFFFAOYSA-N
MW269.77 g/mol
LogP3.01
Rot. Bonds5

About 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine

2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine (PubChem CID 55060618) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine.

Molecular Properties

Compound Name2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine
PubChem CID55060618
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine
SMILESCOc1ccc(Cl)cc1COCC1CCCCN1
InChIInChI=1S/C14H20ClNO2/c1-17-14-6-5-12(15)8-11(14)9-18-10-13-4-2-3-7-16-13/h5-6,8,13,16H,2-4,7,9-10H2,1H3
InChIKeyNJCTUJSZKROMJB-UHFFFAOYSA-N
XLogP3.01
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine 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

(2S)-2-[(2,4-dichlorophenyl)methoxymethyl]piperidine
CID 35754068
N-[(5-chloro-2-methoxyphenyl)methyl]-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106631571
2-[(2,5-difluorophenyl)methoxymethyl]pyrrolidine
CID 62333624
2-[(2-fluoro-3-methoxyphenyl)methoxymethyl]pyrrolidine
CID 104792599
(2S)-2-[(4-methoxyphenyl)methoxymethyl]piperidine
CID 86324715
2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine
CID 65317213
(2S)-2-[(3-chlorophenyl)methoxymethyl]pyrrolidine
CID 35754000
2-[(5-chloro-2-cyclobutyloxyphenyl)methyl]pyrrolidine
CID 117418732
2-[(3-chloro-4-methoxyphenyl)methyl]piperidine
CID 82084437
2-(5-chloro-2-methoxyphenyl)azepane
CID 4015818
2-[(2-chloro-4-fluorophenyl)methoxymethyl]pyrrolidine
CID 62334722
3-[(5-chloro-2-methoxyphenyl)methyl]morpholine
CID 82293165

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine?
The IUPAC name of 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine (CID 55060618) is 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine.
What is the SMILES notation for 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine?
The canonical SMILES for 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine is COc1ccc(Cl)cc1COCC1CCCCN1.
What is the InChIKey of 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine?
The InChIKey is NJCTUJSZKROMJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-17-14-6-5-12(15)8-11(14)9-18-10-13-4-2-3-7-16-13/h5-6,8,13,16H,2-4,7,9-10H2,1H3.
What are the key properties of 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine?
2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine has a molecular weight of 269.77 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine is sourced from PubChem (CID 55060618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).