N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide

C9H10F2N2O3 — CID 104862893

IUPACN-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCC(F)(F)CO)c1ccc[nH]c1=O
InChIInChI=1S/C9H10F2N2O3/c10-9(11,5-14)4-13-8(16)6-2-1-3-12-7(6)15/h1-3,14H,4-5H2,(H,12,15)(H,13,16)
InChIKeyDRIXQCFLAPHSFB-UHFFFAOYSA-N
MW232.19 g/mol
LogP-0.27
Rot. Bonds4

About N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide

N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 104862893) has the molecular formula C9H10F2N2O3 and a molecular weight of 232.19 g/mol. Its IUPAC name is N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID104862893
Molecular FormulaC9H10F2N2O3
Molecular Weight232.19 g/mol
Exact Mass232.07
IUPAC NameN-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCC(F)(F)CO)c1ccc[nH]c1=O
InChIInChI=1S/C9H10F2N2O3/c10-9(11,5-14)4-13-8(16)6-2-1-3-12-7(6)15/h1-3,14H,4-5H2,(H,12,15)(H,13,16)
InChIKeyDRIXQCFLAPHSFB-UHFFFAOYSA-N
XLogP-0.27
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-Oxo-1-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
CID 177250571
N-(2-hydroxyethyl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 43394531
N-(3-hydroxypropyl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 43417634
N-(1-hydroxypropan-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 43419121
2-oxo-N-(2,2,2-trifluoroethyl)-1,2-dihydropyridine-3-carboxamide
CID 45497127
N-(3-hydroxypropyl)-2-oxo-N-propan-2-yl-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 61038804
N-(3-hydroxybutyl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 64459930
N-(3-hydroxy-2-methylpropyl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 65032076
N-[(2S)-1-hydroxypropan-2-yl]-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 65808607
3-[3-(hydroxymethyl)azetidine-1-carbonyl]-6-(trifluoromethyl)-1H-pyridin-2-one
CID 65992876
N-(3-hydroxypropyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 78854231
N-[(2R)-1-hydroxypropan-2-yl]-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 79031421

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide (CID 104862893) is N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide is O=C(NCC(F)(F)CO)c1ccc[nH]c1=O.
What is the InChIKey of N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is DRIXQCFLAPHSFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O3/c10-9(11,5-14)4-13-8(16)6-2-1-3-12-7(6)15/h1-3,14H,4-5H2,(H,12,15)(H,13,16).
What are the key properties of N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide?
N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 232.19 g/mol, XLogP of -0.27, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 104862893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).