2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol

C15H23NO2 — CID 783162

IUPAC2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol
SMILESCCOc1cc(CN2CCCC[C@H]2C)ccc1O
InChIInChI=1S/C15H23NO2/c1-3-18-15-10-13(7-8-14(15)17)11-16-9-5-4-6-12(16)2/h7-8,10,12,17H,3-6,9,11H2,1-2H3/t12-/m1/s1
InChIKeyQHRGMALNVRQKCQ-GFCCVEGCSA-N
MW249.35 g/mol
LogP3.17
Rot. Bonds4

About 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol

2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol (PubChem CID 783162) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol.

Molecular Properties

Compound Name2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol
PubChem CID783162
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol
SMILESCCOc1cc(CN2CCCC[C@H]2C)ccc1O
InChIInChI=1S/C15H23NO2/c1-3-18-15-10-13(7-8-14(15)17)11-16-9-5-4-6-12(16)2/h7-8,10,12,17H,3-6,9,11H2,1-2H3/t12-/m1/s1
InChIKeyQHRGMALNVRQKCQ-GFCCVEGCSA-N
XLogP3.17
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl (2R)-1-[(3-ethoxy-4-hydroxyphenyl)methyl]piperidine-2-carboxylate
CID 40633764
(2S,3S)-1-[(3-ethoxy-4-hydroxyphenyl)methyl]-2-methylpiperidine-3-carboxylic acid
CID 167949979
2-methoxy-5-[(2-methylazepan-1-yl)methyl]phenol
CID 82980366
4-(2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridin-1-ylmethyl)-2-ethoxyphenol
CID 102677867
2-ethoxy-4-[(4-ethyl-3-methylpiperazin-1-yl)methyl]phenol
CID 82980462
N-cyclopentyl-1-[(3-ethoxy-4-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 3645638
1-[(3-ethoxy-4-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 5180016
2-ethoxy-4-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol
CID 82981139
ethyl (2R)-1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidine-2-carboxylate
CID 792510
2-ethoxy-4-[[3-(methoxymethyl)piperidin-1-yl]methyl]phenol
CID 106590288
2-ethoxy-4-[(2-hydroxycyclohexyl)methyl]phenol
CID 82185867
2-ethoxy-4-(piperazin-1-ylmethyl)phenol
CID 54914762

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol?
The IUPAC name of 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol (CID 783162) is 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol.
What is the SMILES notation for 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol?
The canonical SMILES for 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol is CCOc1cc(CN2CCCC[C@H]2C)ccc1O.
What is the InChIKey of 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol?
The InChIKey is QHRGMALNVRQKCQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-18-15-10-13(7-8-14(15)17)11-16-9-5-4-6-12(16)2/h7-8,10,12,17H,3-6,9,11H2,1-2H3/t12-/m1/s1.
What are the key properties of 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol?
2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol has a molecular weight of 249.35 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol is sourced from PubChem (CID 783162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).