N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide

C16H18N2O2 — CID 24747793

IUPACN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide
SMILESO=C(Cc1ccncc1)N[C@H](CO)Cc1ccccc1
InChIInChI=1S/C16H18N2O2/c19-12-15(10-13-4-2-1-3-5-13)18-16(20)11-14-6-8-17-9-7-14/h1-9,15,19H,10-12H2,(H,18,20)/t15-/m0/s1
InChIKeyOYHBEYDKQWEWBX-HNNXBMFYSA-N
MW270.33 g/mol
LogP1.34
Rot. Bonds6

About N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide

N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide (PubChem CID 24747793) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide
PubChem CID24747793
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide
SMILESO=C(Cc1ccncc1)N[C@H](CO)Cc1ccccc1
InChIInChI=1S/C16H18N2O2/c19-12-15(10-13-4-2-1-3-5-13)18-16(20)11-14-6-8-17-9-7-14/h1-9,15,19H,10-12H2,(H,18,20)/t15-/m0/s1
InChIKeyOYHBEYDKQWEWBX-HNNXBMFYSA-N
XLogP1.34
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide?
The IUPAC name of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide (CID 24747793) is N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide is O=C(Cc1ccncc1)N[C@H](CO)Cc1ccccc1.
What is the InChIKey of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide?
The InChIKey is OYHBEYDKQWEWBX-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H18N2O2/c19-12-15(10-13-4-2-1-3-5-13)18-16(20)11-14-6-8-17-9-7-14/h1-9,15,19H,10-12H2,(H,18,20)/t15-/m0/s1.
What are the key properties of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide?
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide has a molecular weight of 270.33 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-4-ylacetamide is sourced from PubChem (CID 24747793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).