(2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol

C17H25NO3 — CID 14565954

IUPAC(2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol
SMILESOC[C@@H](c1ccccc1)N1CCCC[C@@H]1CC1OCCO1
InChIInChI=1S/C17H25NO3/c19-13-16(14-6-2-1-3-7-14)18-9-5-4-8-15(18)12-17-20-10-11-21-17/h1-3,6-7,15-17,19H,4-5,8-13H2/t15-,16+/m1/s1
InChIKeyVCAPXJHMZSHZTM-CVEARBPZSA-N
MW291.39 g/mol
LogP2.34
Rot. Bonds5

About (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol

(2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol (PubChem CID 14565954) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol
PubChem CID14565954
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name(2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol
SMILESOC[C@@H](c1ccccc1)N1CCCC[C@@H]1CC1OCCO1
InChIInChI=1S/C17H25NO3/c19-13-16(14-6-2-1-3-7-14)18-9-5-4-8-15(18)12-17-20-10-11-21-17/h1-3,6-7,15-17,19H,4-5,8-13H2/t15-,16+/m1/s1
InChIKeyVCAPXJHMZSHZTM-CVEARBPZSA-N
XLogP2.34
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Piperidineethanol, beta-phenyl-
CID 199647
2-Morpholin-4-yl-2-phenylethanol
CID 10899797
Aprepitant Impurity 81
CID 123159573
(2S,3R)-3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholin-2-ol
CID 11833536
(2S,3S)-3-(4-fluorophenyl)-2,4-dimethylmorpholin-2-ol
CID 134848052
(2S,3S)-2-ethyl-3-(4-fluorophenyl)-4-methylmorpholin-2-ol
CID 134861765
(2R)-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-phenylethanol
CID 15327289
trans-4-Benzyl-3-phenyl-morpholin-2-ol
CID 10516129
4-Benzyl-3-phenylmorpholin-2-ol
CID 15501116
(2S)-2-(1,3-dioxolan-2-ylmethylamino)-2-phenylethanol
CID 75501635
(2R)-2-(4-fluorophenyl)-2-[(3S)-3-(oxan-2-yloxy)pyrrolidin-1-yl]ethanol
CID 21970352
(2S,3R)-4-benzyl-3-(4-fluorophenyl)morpholin-2-ol
CID 24770313

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol?
The IUPAC name of (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol (CID 14565954) is (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol is OC[C@@H](c1ccccc1)N1CCCC[C@@H]1CC1OCCO1.
What is the InChIKey of (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol?
The InChIKey is VCAPXJHMZSHZTM-CVEARBPZSA-N. The full InChI is InChI=1S/C17H25NO3/c19-13-16(14-6-2-1-3-7-14)18-9-5-4-8-15(18)12-17-20-10-11-21-17/h1-3,6-7,15-17,19H,4-5,8-13H2/t15-,16+/m1/s1.
What are the key properties of (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol?
(2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol has a molecular weight of 291.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2R)-2-(1,3-dioxolan-2-ylmethyl)piperidin-1-yl]-2-phenylethanol is sourced from PubChem (CID 14565954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).