2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide

C16H16N2O3 — CID 96570780

IUPAC2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide
SMILESO=C(N[C@@H]1CCO[C@H]1c1ccccc1)c1ccc[nH]c1=O
InChIInChI=1S/C16H16N2O3/c19-15-12(7-4-9-17-15)16(20)18-13-8-10-21-14(13)11-5-2-1-3-6-11/h1-7,9,13-14H,8,10H2,(H,17,19)(H,18,20)/t13-,14+/m1/s1
InChIKeyIIXQIMWZDALIGT-KGLIPLIRSA-N
MW284.31 g/mol
LogP1.63
Rot. Bonds3

About 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide

2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide (PubChem CID 96570780) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide
PubChem CID96570780
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide
SMILESO=C(N[C@@H]1CCO[C@H]1c1ccccc1)c1ccc[nH]c1=O
InChIInChI=1S/C16H16N2O3/c19-15-12(7-4-9-17-15)16(20)18-13-8-10-21-14(13)11-5-2-1-3-6-11/h1-7,9,13-14H,8,10H2,(H,17,19)(H,18,20)/t13-,14+/m1/s1
InChIKeyIIXQIMWZDALIGT-KGLIPLIRSA-N
XLogP1.63
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide?
The IUPAC name of 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide (CID 96570780) is 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide is O=C(N[C@@H]1CCO[C@H]1c1ccccc1)c1ccc[nH]c1=O.
What is the InChIKey of 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide?
The InChIKey is IIXQIMWZDALIGT-KGLIPLIRSA-N. The full InChI is InChI=1S/C16H16N2O3/c19-15-12(7-4-9-17-15)16(20)18-13-8-10-21-14(13)11-5-2-1-3-6-11/h1-7,9,13-14H,8,10H2,(H,17,19)(H,18,20)/t13-,14+/m1/s1.
What are the key properties of 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide?
2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[(2S,3R)-2-phenyloxolan-3-yl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 96570780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).