(3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide

C15H20N2O2 — CID 806483

IUPAC(3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide
SMILESC[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCNC1=O
InChIInChI=1S/C15H20N2O2/c1-11(10-12-6-3-2-4-7-12)17-15(19)13-8-5-9-16-14(13)18/h2-4,6-7,11,13H,5,8-10H2,1H3,(H,16,18)(H,17,19)/t11-,13+/m1/s1
InChIKeyGBEIJZKCDDUPQQ-YPMHNXCESA-N
MW260.34 g/mol
LogP1.26
Rot. Bonds4

About (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide

(3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide (PubChem CID 806483) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide
PubChem CID806483
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide
SMILESC[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCNC1=O
InChIInChI=1S/C15H20N2O2/c1-11(10-12-6-3-2-4-7-12)17-15(19)13-8-5-9-16-14(13)18/h2-4,6-7,11,13H,5,8-10H2,1H3,(H,16,18)(H,17,19)/t11-,13+/m1/s1
InChIKeyGBEIJZKCDDUPQQ-YPMHNXCESA-N
XLogP1.26
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide?
The IUPAC name of (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide (CID 806483) is (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide.
What is the SMILES notation for (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide?
The canonical SMILES for (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide is C[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCNC1=O.
What is the InChIKey of (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide?
The InChIKey is GBEIJZKCDDUPQQ-YPMHNXCESA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11(10-12-6-3-2-4-7-12)17-15(19)13-8-5-9-16-14(13)18/h2-4,6-7,11,13H,5,8-10H2,1H3,(H,16,18)(H,17,19)/t11-,13+/m1/s1.
What are the key properties of (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide?
(3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2-oxo-N-[(2R)-1-phenylpropan-2-yl]piperidine-3-carboxamide is sourced from PubChem (CID 806483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).