(3S,4S)-4-phenylpiperidin-3-ol

C11H15NO — CID 16671922

IUPAC(3S,4S)-4-phenylpiperidin-3-ol
SMILESO[C@@H]1CNCC[C@H]1c1ccccc1
InChIInChI=1S/C11H15NO/c13-11-8-12-7-6-10(11)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2/t10-,11+/m0/s1
InChIKeyKPIUNMRQJGMTGZ-WDEREUQCSA-N
MW177.25 g/mol
LogP1.12
Rot. Bonds1

About (3S,4S)-4-phenylpiperidin-3-ol

(3S,4S)-4-phenylpiperidin-3-ol (PubChem CID 16671922) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (3S,4S)-4-phenylpiperidin-3-ol.

Molecular Properties

Compound Name(3S,4S)-4-phenylpiperidin-3-ol
PubChem CID16671922
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(3S,4S)-4-phenylpiperidin-3-ol
SMILESO[C@@H]1CNCC[C@H]1c1ccccc1
InChIInChI=1S/C11H15NO/c13-11-8-12-7-6-10(11)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2/t10-,11+/m0/s1
InChIKeyKPIUNMRQJGMTGZ-WDEREUQCSA-N
XLogP1.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S,4S)-4-phenylpiperidin-3-ol?
The IUPAC name of (3S,4S)-4-phenylpiperidin-3-ol (CID 16671922) is (3S,4S)-4-phenylpiperidin-3-ol.
What is the SMILES notation for (3S,4S)-4-phenylpiperidin-3-ol?
The canonical SMILES for (3S,4S)-4-phenylpiperidin-3-ol is O[C@@H]1CNCC[C@H]1c1ccccc1.
What is the InChIKey of (3S,4S)-4-phenylpiperidin-3-ol?
The InChIKey is KPIUNMRQJGMTGZ-WDEREUQCSA-N. The full InChI is InChI=1S/C11H15NO/c13-11-8-12-7-6-10(11)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2/t10-,11+/m0/s1.
What are the key properties of (3S,4S)-4-phenylpiperidin-3-ol?
(3S,4S)-4-phenylpiperidin-3-ol has a molecular weight of 177.25 g/mol, XLogP of 1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4S)-4-phenylpiperidin-3-ol is sourced from PubChem (CID 16671922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).