(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol

C15H23NO2 — CID 55183213

IUPAC(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol
SMILESCCOC1CCCN(c2ccccc2[C@@H](C)O)C1
InChIInChI=1S/C15H23NO2/c1-3-18-13-7-6-10-16(11-13)15-9-5-4-8-14(15)12(2)17/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3/t12-,13?/m1/s1
InChIKeyDIWLKWKDJVNRRD-PZORYLMUSA-N
MW249.35 g/mol
LogP2.75
Rot. Bonds4

About (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol

(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol (PubChem CID 55183213) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol
PubChem CID55183213
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol
SMILESCCOC1CCCN(c2ccccc2[C@@H](C)O)C1
InChIInChI=1S/C15H23NO2/c1-3-18-13-7-6-10-16(11-13)15-9-5-4-8-14(15)12(2)17/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3/t12-,13?/m1/s1
InChIKeyDIWLKWKDJVNRRD-PZORYLMUSA-N
XLogP2.75
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 ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3-propoxypiperidin-1-yl)phenyl]ethanamine
CID 54989682
2-(3-ethoxypiperidin-1-yl)benzaldehyde
CID 54990320
1-[3-chloro-4-(3-ethoxypiperidin-1-yl)phenyl]ethanol
CID 62910229
(1R)-1-[2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl]ethanol
CID 78941146
2-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanamine
CID 63787234
(1S)-1-[2-[3-(methoxymethyl)pyrrolidin-1-yl]phenyl]ethanol
CID 64597981
1-[3-chloro-2-(chloromethyl)phenyl]-3-ethoxypiperidine
CID 54989891
(1R)-1-[2-[3-(hydroxymethyl)pyrrolidin-1-yl]phenyl]ethanol
CID 103942831
1-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)phenyl]ethanol
CID 63170127
(1S)-1-[2-(3,4-dimethylpiperazin-1-yl)phenyl]ethanol
CID 63610426
(1S)-1-[2-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]ethanol
CID 63372106
1-[2-(3-methylpiperidin-1-yl)phenyl]propan-1-ol
CID 112678761

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol?
The IUPAC name of (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol (CID 55183213) is (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol is CCOC1CCCN(c2ccccc2[C@@H](C)O)C1.
What is the InChIKey of (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol?
The InChIKey is DIWLKWKDJVNRRD-PZORYLMUSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-18-13-7-6-10-16(11-13)15-9-5-4-8-14(15)12(2)17/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3/t12-,13?/m1/s1.
What are the key properties of (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol?
(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol has a molecular weight of 249.35 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol is sourced from PubChem (CID 55183213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).