2-phenylmethoxy-4-piperidin-3-ylphenol

C18H21NO2 — CID 117455625

IUPAC2-phenylmethoxy-4-piperidin-3-ylphenol
SMILESOc1ccc(C2CCCNC2)cc1OCc1ccccc1
InChIInChI=1S/C18H21NO2/c20-17-9-8-15(16-7-4-10-19-12-16)11-18(17)21-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16,19-20H,4,7,10,12-13H2
InChIKeyQBSUNBNBIDXGAE-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.44
Rot. Bonds4

About 2-phenylmethoxy-4-piperidin-3-ylphenol

2-phenylmethoxy-4-piperidin-3-ylphenol (PubChem CID 117455625) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-phenylmethoxy-4-piperidin-3-ylphenol.

Molecular Properties

Compound Name2-phenylmethoxy-4-piperidin-3-ylphenol
PubChem CID117455625
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-phenylmethoxy-4-piperidin-3-ylphenol
SMILESOc1ccc(C2CCCNC2)cc1OCc1ccccc1
InChIInChI=1S/C18H21NO2/c20-17-9-8-15(16-7-4-10-19-12-16)11-18(17)21-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16,19-20H,4,7,10,12-13H2
InChIKeyQBSUNBNBIDXGAE-UHFFFAOYSA-N
XLogP3.44
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-morpholin-2-yl-2-phenylmethoxyphenol
CID 117459594
2-(2-amino-6-piperidin-3-ylpyrimidin-4-yl)-3-phenylmethoxyphenol
CID 142686963
4-piperidin-3-ylbenzene-1,2-diol;hydrobromide
CID 3046209
2-fluoro-4-piperidin-3-ylphenol
CID 82606236
2-methyl-4-piperidin-3-ylphenol
CID 84663479
3-[(4-piperidin-3-ylphenoxy)methyl]benzoic acid
CID 117100164
4-phenylmethoxy-3-piperidin-3-yl-1H-indole
CID 82212323
2-[6-amino-5-(hydroxymethyl)-4-piperidin-3-yl-2-pyridinyl]-3-phenylmethoxyphenol;methane
CID 157188587
N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide
CID 54794739
2-amino-6-(2-hydroxy-6-phenylmethoxyphenyl)-4-piperidin-3-ylpyridine-3-carbaldehyde;hydrochloride
CID 135550596
4-cyclopropyl-2-phenylmethoxybenzoic acid
CID 162369981
6-phenylmethoxy-2,3-dihydro-1H-inden-5-ol
CID 13059019

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-4-piperidin-3-ylphenol?
The IUPAC name of 2-phenylmethoxy-4-piperidin-3-ylphenol (CID 117455625) is 2-phenylmethoxy-4-piperidin-3-ylphenol.
What is the SMILES notation for 2-phenylmethoxy-4-piperidin-3-ylphenol?
The canonical SMILES for 2-phenylmethoxy-4-piperidin-3-ylphenol is Oc1ccc(C2CCCNC2)cc1OCc1ccccc1.
What is the InChIKey of 2-phenylmethoxy-4-piperidin-3-ylphenol?
The InChIKey is QBSUNBNBIDXGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c20-17-9-8-15(16-7-4-10-19-12-16)11-18(17)21-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16,19-20H,4,7,10,12-13H2.
What are the key properties of 2-phenylmethoxy-4-piperidin-3-ylphenol?
2-phenylmethoxy-4-piperidin-3-ylphenol has a molecular weight of 283.37 g/mol, XLogP of 3.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-4-piperidin-3-ylphenol is sourced from PubChem (CID 117455625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).