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

C16H25NO2 — CID 14201549

IUPAC(1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol
SMILESO[C@@H](COCCCc1ccccc1)[C@H]1CCCCN1
InChIInChI=1S/C16H25NO2/c18-16(15-10-4-5-11-17-15)13-19-12-6-9-14-7-2-1-3-8-14/h1-3,7-8,15-18H,4-6,9-13H2/t15-,16+/m1/s1
InChIKeyPAWPHGFYSPEYBZ-CVEARBPZSA-N
MW263.38 g/mol
LogP2.14
Rot. Bonds7

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

(1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol (PubChem CID 14201549) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol.

Molecular Properties

Compound Name(1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol
PubChem CID14201549
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name(1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol
SMILESO[C@@H](COCCCc1ccccc1)[C@H]1CCCCN1
InChIInChI=1S/C16H25NO2/c18-16(15-10-4-5-11-17-15)13-19-12-6-9-14-7-2-1-3-8-14/h1-3,7-8,15-18H,4-6,9-13H2/t15-,16+/m1/s1
InChIKeyPAWPHGFYSPEYBZ-CVEARBPZSA-N
XLogP2.14
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol 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

2-(4-phenylphenoxy)-1-piperidin-2-ylethanol
CID 14500424
(2R,3R)-3-chloro-1,4-bis(3-phenylpropoxy)butan-2-ol
CID 134933929
2-[2-(4-phenylbutoxy)ethyl]piperidine
CID 114334035
3-(3-phenylpropoxy)propane-1,2-diol
CID 66597635
(1S)-2-[dimethyl(phenyl)-λ4-sulfanyl]-1-[(2S)-piperidin-2-yl]ethanol
CID 155010585
1-(3-phenylpropoxy)-3-sulfanylpropan-2-ol
CID 175040300
benzyl (2S)-2-hydroxy-2-[(2S)-pyrrolidin-2-yl]ethanesulfonate
CID 155141546
2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 164662041
1-(3-phenylpropoxy)pentan-2-ol
CID 62042803
methyl (2R)-3-phenyl-2-[(2R)-piperidin-2-yl]propanoate
CID 10490732
1-(3-aminophenyl)-2-(3-phenylpropoxy)ethanol
CID 62268993
(2R)-1-(3-phenylpropoxy)propan-2-amine
CID 15118942

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol?
The IUPAC name of (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol (CID 14201549) is (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol.
What is the SMILES notation for (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol?
The canonical SMILES for (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol is O[C@@H](COCCCc1ccccc1)[C@H]1CCCCN1.
What is the InChIKey of (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol?
The InChIKey is PAWPHGFYSPEYBZ-CVEARBPZSA-N. The full InChI is InChI=1S/C16H25NO2/c18-16(15-10-4-5-11-17-15)13-19-12-6-9-14-7-2-1-3-8-14/h1-3,7-8,15-18H,4-6,9-13H2/t15-,16+/m1/s1.
What are the key properties of (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol?
(1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol has a molecular weight of 263.38 g/mol, XLogP of 2.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(3-phenylpropoxy)-1-[(2R)-piperidin-2-yl]ethanol is sourced from PubChem (CID 14201549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).