2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine

C15H23NO — CID 117339226

IUPAC2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine
SMILESCOCCc1ccc(CC2CCCCN2)cc1
InChIInChI=1S/C15H23NO/c1-17-11-9-13-5-7-14(8-6-13)12-15-4-2-3-10-16-15/h5-8,15-16H,2-4,9-12H2,1H3
InChIKeyXZJKNQXBAFNZSG-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.56
Rot. Bonds5

About 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine

2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine (PubChem CID 117339226) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine.

Molecular Properties

Compound Name2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine
PubChem CID117339226
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine
SMILESCOCCc1ccc(CC2CCCCN2)cc1
InChIInChI=1S/C15H23NO/c1-17-11-9-13-5-7-14(8-6-13)12-15-4-2-3-10-16-15/h5-8,15-16H,2-4,9-12H2,1H3
InChIKeyXZJKNQXBAFNZSG-UHFFFAOYSA-N
XLogP2.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[(4-methylphenyl)methyl]piperidine
CID 7048103
2-[[4-(2-methoxypropyl)phenyl]methyl]piperidine
CID 117371935
2-[[4-(1,2-dimethoxyethyl)phenyl]methyl]pyrrolidine
CID 117377105
2-[(4-cyclopropylphenyl)methyl]piperidine
CID 117307185
2-[[4-(2-fluoroethyl)phenyl]methyl]pyrrolidine
CID 117296650
2-[4-(pyrrolidin-2-ylmethyl)phenyl]ethanamine
CID 178108165
2-[(4-methylphenyl)methyl]pyrrolidine
CID 3510571
(2S)-2-[[4-(2-methylpropoxy)phenyl]methyl]piperidine
CID 39345713
2-[[4-(4-methoxyphenyl)phenyl]methyl]pyrrolidine
CID 82341654
2-[(4-propan-2-ylsulfanylphenyl)methyl]piperidine
CID 82499085
1-[4-(piperidin-2-ylmethyl)phenyl]propan-2-ol
CID 117339227
2-[(4-butan-2-ylphenyl)methyl]piperidine
CID 82341703

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine?
The IUPAC name of 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine (CID 117339226) is 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine.
What is the SMILES notation for 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine?
The canonical SMILES for 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine is COCCc1ccc(CC2CCCCN2)cc1.
What is the InChIKey of 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine?
The InChIKey is XZJKNQXBAFNZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-17-11-9-13-5-7-14(8-6-13)12-15-4-2-3-10-16-15/h5-8,15-16H,2-4,9-12H2,1H3.
What are the key properties of 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine?
2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine has a molecular weight of 233.35 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2-methoxyethyl)phenyl]methyl]piperidine is sourced from PubChem (CID 117339226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).