(1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol

C14H21NO — CID 56652580

IUPAC(1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol
SMILESO[C@H](CCc1ccccc1)[C@H]1CCCCN1
InChIInChI=1S/C14H21NO/c16-14(13-8-4-5-11-15-13)10-9-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1
InChIKeyXWLKGLPMTCQPQI-ZIAGYGMSSA-N
MW219.33 g/mol
LogP2.12
Rot. Bonds4

About (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol

(1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol (PubChem CID 56652580) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name(1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol
PubChem CID56652580
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol
SMILESO[C@H](CCc1ccccc1)[C@H]1CCCCN1
InChIInChI=1S/C14H21NO/c16-14(13-8-4-5-11-15-13)10-9-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1
InChIKeyXWLKGLPMTCQPQI-ZIAGYGMSSA-N
XLogP2.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol?
The IUPAC name of (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol (CID 56652580) is (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol.
What is the SMILES notation for (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol?
The canonical SMILES for (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol is O[C@H](CCc1ccccc1)[C@H]1CCCCN1.
What is the InChIKey of (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol?
The InChIKey is XWLKGLPMTCQPQI-ZIAGYGMSSA-N. The full InChI is InChI=1S/C14H21NO/c16-14(13-8-4-5-11-15-13)10-9-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1.
What are the key properties of (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol?
(1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-phenyl-1-[(2R)-piperidin-2-yl]propan-1-ol is sourced from PubChem (CID 56652580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).