(2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol

C15H23NO — CID 16719767

IUPAC(2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol
SMILESCCN1CCCC[C@@H]1[C@H](CO)c1ccccc1
InChIInChI=1S/C15H23NO/c1-2-16-11-7-6-10-15(16)14(12-17)13-8-4-3-5-9-13/h3-5,8-9,14-15,17H,2,6-7,10-12H2,1H3/t14-,15-/m1/s1
InChIKeyBHAGCFGXKSMVPG-HUUCEWRRSA-N
MW233.36 g/mol
LogP2.64
Rot. Bonds4

About (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol

(2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol (PubChem CID 16719767) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol
PubChem CID16719767
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name(2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol
SMILESCCN1CCCC[C@@H]1[C@H](CO)c1ccccc1
InChIInChI=1S/C15H23NO/c1-2-16-11-7-6-10-15(16)14(12-17)13-8-4-3-5-9-13/h3-5,8-9,14-15,17H,2,6-7,10-12H2,1H3/t14-,15-/m1/s1
InChIKeyBHAGCFGXKSMVPG-HUUCEWRRSA-N
XLogP2.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol?
The IUPAC name of (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol (CID 16719767) is (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol is CCN1CCCC[C@@H]1[C@H](CO)c1ccccc1.
What is the InChIKey of (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol?
The InChIKey is BHAGCFGXKSMVPG-HUUCEWRRSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-16-11-7-6-10-15(16)14(12-17)13-8-4-3-5-9-13/h3-5,8-9,14-15,17H,2,6-7,10-12H2,1H3/t14-,15-/m1/s1.
What are the key properties of (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol?
(2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol has a molecular weight of 233.36 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2R)-1-ethylpiperidin-2-yl]-2-phenylethanol is sourced from PubChem (CID 16719767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).