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

C22H29NO — CID 52945256

IUPAC(2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol
SMILESOC[C@H](c1ccccc1)[C@H]1CCCCN1CCCc1ccccc1
InChIInChI=1S/C22H29NO/c24-18-21(20-13-5-2-6-14-20)22-15-7-8-16-23(22)17-9-12-19-10-3-1-4-11-19/h1-6,10-11,13-14,21-22,24H,7-9,12,15-18H2/t21-,22-/m1/s1
InChIKeyQQICWLNJJOCDRX-FGZHOGPDSA-N
MW323.48 g/mol
LogP4.25
Rot. Bonds7

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

(2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol (PubChem CID 52945256) has the molecular formula C22H29NO and a molecular weight of 323.48 g/mol. Its IUPAC name is (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name(2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol
PubChem CID52945256
Molecular FormulaC22H29NO
Molecular Weight323.48 g/mol
Exact Mass323.22
IUPAC Name(2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol
SMILESOC[C@H](c1ccccc1)[C@H]1CCCCN1CCCc1ccccc1
InChIInChI=1S/C22H29NO/c24-18-21(20-13-5-2-6-14-20)22-15-7-8-16-23(22)17-9-12-19-10-3-1-4-11-19/h1-6,10-11,13-14,21-22,24H,7-9,12,15-18H2/t21-,22-/m1/s1
InChIKeyQQICWLNJJOCDRX-FGZHOGPDSA-N
XLogP4.25
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.48
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol?
The IUPAC name of (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol (CID 52945256) is (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol.
What is the SMILES notation for (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol?
The canonical SMILES for (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol is OC[C@H](c1ccccc1)[C@H]1CCCCN1CCCc1ccccc1.
What is the InChIKey of (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol?
The InChIKey is QQICWLNJJOCDRX-FGZHOGPDSA-N. The full InChI is InChI=1S/C22H29NO/c24-18-21(20-13-5-2-6-14-20)22-15-7-8-16-23(22)17-9-12-19-10-3-1-4-11-19/h1-6,10-11,13-14,21-22,24H,7-9,12,15-18H2/t21-,22-/m1/s1.
What are the key properties of (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol?
(2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol has a molecular weight of 323.48 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-[(2R)-1-(3-phenylpropyl)piperidin-2-yl]ethanol is sourced from PubChem (CID 52945256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).