6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide

C17H17FN2O3 — CID 95554649

IUPAC6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide
SMILESO=C(NC[C@H]1CCCO1)c1ccc(-c2ccc(F)cc2)[nH]c1=O
InChIInChI=1S/C17H17FN2O3/c18-12-5-3-11(4-6-12)15-8-7-14(17(22)20-15)16(21)19-10-13-2-1-9-23-13/h3-8,13H,1-2,9-10H2,(H,19,21)(H,20,22)/t13-/m1/s1
InChIKeyJHDFHWQBCGJLMT-CYBMUJFWSA-N
MW316.33 g/mol
LogP2.09
Rot. Bonds4

About 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide

6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide (PubChem CID 95554649) has the molecular formula C17H17FN2O3 and a molecular weight of 316.33 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide
PubChem CID95554649
Molecular FormulaC17H17FN2O3
Molecular Weight316.33 g/mol
Exact Mass316.12
IUPAC Name6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide
SMILESO=C(NC[C@H]1CCCO1)c1ccc(-c2ccc(F)cc2)[nH]c1=O
InChIInChI=1S/C17H17FN2O3/c18-12-5-3-11(4-6-12)15-8-7-14(17(22)20-15)16(21)19-10-13-2-1-9-23-13/h3-8,13H,1-2,9-10H2,(H,19,21)(H,20,22)/t13-/m1/s1
InChIKeyJHDFHWQBCGJLMT-CYBMUJFWSA-N
XLogP2.09
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide
CID 95976180
2-oxo-N-[2-[(2R)-oxolan-2-yl]ethyl]-6-phenyl-1H-pyridine-3-carboxamide
CID 95976361
4-fluoro-N-(oxolan-2-ylmethyl)benzamide
CID 531952
5-fluoro-2-iodo-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 95155012
7-fluoro-N-(oxan-2-ylmethyl)-2-oxo-1H-quinoline-4-carboxamide
CID 121495129
5-(4-fluorophenyl)-N-[[(2R)-oxolan-2-yl]methyl]-1,2-oxazole-3-carboxamide
CID 99599447
3-(4-fluorophenyl)-N-[[(2R)-oxolan-2-yl]methyl]-1,2-oxazole-5-carboxamide
CID 40649827
2-fluoro-4-hydroxy-N-(oxolan-2-ylmethyl)benzamide
CID 113355583
N-(cyclopropylmethyl)-6-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 66497565
2,3-difluoro-4-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 2938828
2-[(4-fluorobenzoyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 7378690
4,5-difluoro-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 7391199

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide (CID 95554649) is 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide is O=C(NC[C@H]1CCCO1)c1ccc(-c2ccc(F)cc2)[nH]c1=O.
What is the InChIKey of 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide?
The InChIKey is JHDFHWQBCGJLMT-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H17FN2O3/c18-12-5-3-11(4-6-12)15-8-7-14(17(22)20-15)16(21)19-10-13-2-1-9-23-13/h3-8,13H,1-2,9-10H2,(H,19,21)(H,20,22)/t13-/m1/s1.
What are the key properties of 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide?
6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide has a molecular weight of 316.33 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 95554649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).