2-[(2-propoxyphenyl)methyl]piperidine

C15H23NO — CID 104662380

IUPAC2-[(2-propoxyphenyl)methyl]piperidine
SMILESCCCOc1ccccc1CC1CCCCN1
InChIInChI=1S/C15H23NO/c1-2-11-17-15-9-4-3-7-13(15)12-14-8-5-6-10-16-14/h3-4,7,9,14,16H,2,5-6,8,10-12H2,1H3
InChIKeyOOIDNJMFFRURGA-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.16
Rot. Bonds5

About 2-[(2-propoxyphenyl)methyl]piperidine

2-[(2-propoxyphenyl)methyl]piperidine (PubChem CID 104662380) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-[(2-propoxyphenyl)methyl]piperidine.

Molecular Properties

Compound Name2-[(2-propoxyphenyl)methyl]piperidine
PubChem CID104662380
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-[(2-propoxyphenyl)methyl]piperidine
SMILESCCCOc1ccccc1CC1CCCCN1
InChIInChI=1S/C15H23NO/c1-2-11-17-15-9-4-3-7-13(15)12-14-8-5-6-10-16-14/h3-4,7,9,14,16H,2,5-6,8,10-12H2,1H3
InChIKeyOOIDNJMFFRURGA-UHFFFAOYSA-N
XLogP3.16
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 ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 117336983
(2R)-2-[(2-methylphenyl)methyl]pyrrolidine
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2-[2-(2-propan-2-ylphenoxy)ethyl]piperidine
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2-[2-(2,3-dimethoxyphenoxy)ethyl]piperidine
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CID 138039409
2-[2-(2-phenylphenoxy)ethyl]piperidine
CID 43149968
2-propoxy-N-(1-pyrrolidin-2-ylpropan-2-yl)aniline
CID 79540145
[2-[[(2R)-pyrrolidin-2-yl]methoxy]phenyl]methanol
CID 102820156
2-phenylmethoxy-6-(pyrrolidin-2-ylmethyl)phenol
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2-[(3-methoxy-2-methylsulfonylphenyl)methyl]piperidine
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Frequently Asked Questions

What is the IUPAC name of 2-[(2-propoxyphenyl)methyl]piperidine?
The IUPAC name of 2-[(2-propoxyphenyl)methyl]piperidine (CID 104662380) is 2-[(2-propoxyphenyl)methyl]piperidine.
What is the SMILES notation for 2-[(2-propoxyphenyl)methyl]piperidine?
The canonical SMILES for 2-[(2-propoxyphenyl)methyl]piperidine is CCCOc1ccccc1CC1CCCCN1.
What is the InChIKey of 2-[(2-propoxyphenyl)methyl]piperidine?
The InChIKey is OOIDNJMFFRURGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-11-17-15-9-4-3-7-13(15)12-14-8-5-6-10-16-14/h3-4,7,9,14,16H,2,5-6,8,10-12H2,1H3.
What are the key properties of 2-[(2-propoxyphenyl)methyl]piperidine?
2-[(2-propoxyphenyl)methyl]piperidine has a molecular weight of 233.35 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-propoxyphenyl)methyl]piperidine is sourced from PubChem (CID 104662380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).