2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol

C19H23NO2 — CID 117479063

IUPAC2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol
SMILESOc1c(CC2CCNCC2)cccc1OCc1ccccc1
InChIInChI=1S/C19H23NO2/c21-19-17(13-15-9-11-20-12-10-15)7-4-8-18(19)22-14-16-5-2-1-3-6-16/h1-8,15,20-21H,9-14H2
InChIKeyHEQYGJHICSOYQF-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.51
Rot. Bonds5

About 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol

2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol (PubChem CID 117479063) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol.

Molecular Properties

Compound Name2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol
PubChem CID117479063
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol
SMILESOc1c(CC2CCNCC2)cccc1OCc1ccccc1
InChIInChI=1S/C19H23NO2/c21-19-17(13-15-9-11-20-12-10-15)7-4-8-18(19)22-14-16-5-2-1-3-6-16/h1-8,15,20-21H,9-14H2
InChIKeyHEQYGJHICSOYQF-UHFFFAOYSA-N
XLogP3.51
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenylmethoxy-6-(pyrrolidin-2-ylmethyl)phenol
CID 117455633
2-methoxy-6-(piperidin-4-ylmethyl)phenol
CID 117316216
4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine
CID 142656770
4-[(2-phenylmethoxyphenoxy)methyl]piperidine;hydrochloride
CID 164512463
2-(aminomethyl)-6-phenylmethoxyphenol
CID 117330545
N-[[2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1-piperidin-4-ylmethanamine;dihydrochloride
CID 17155048
2-bromo-6-phenylmethoxyphenol
CID 67346586
4-[3-[2-[(4-chlorophenyl)methoxy]phenyl]propyl]piperidine
CID 160587805
methyl 2-hydroxy-3-(piperidin-4-ylmethyl)benzoate
CID 118948751
[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol
CID 54499676
4-[[2-(difluoromethoxy)phenyl]methyl]piperidine
CID 117355180
tert-butyl 4-[(2-phenylmethoxyphenyl)methyl]piperidine-1-carboxylate;bis(1-[ethoxy(ethyl)phosphoryl]oxyethane);4-[(2-phenylmethoxyphenyl)methyl]piperidine
CID 159371537

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol?
The IUPAC name of 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol (CID 117479063) is 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol.
What is the SMILES notation for 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol?
The canonical SMILES for 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol is Oc1c(CC2CCNCC2)cccc1OCc1ccccc1.
What is the InChIKey of 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol?
The InChIKey is HEQYGJHICSOYQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c21-19-17(13-15-9-11-20-12-10-15)7-4-8-18(19)22-14-16-5-2-1-3-6-16/h1-8,15,20-21H,9-14H2.
What are the key properties of 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol?
2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol has a molecular weight of 297.40 g/mol, XLogP of 3.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol is sourced from PubChem (CID 117479063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).