6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide

C19H14FN3O4 — CID 66497751

IUPAC6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(-c2ccc(F)cc2)[nH]c1=O
InChIInChI=1S/C19H14FN3O4/c1-11-2-7-14(23(26)27)10-17(11)22-19(25)15-8-9-16(21-18(15)24)12-3-5-13(20)6-4-12/h2-10H,1H3,(H,21,24)(H,22,25)
InChIKeyTYBGSXIDFCHNDG-UHFFFAOYSA-N
MW367.34 g/mol
LogP3.65
Rot. Bonds4

About 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide

6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 66497751) has the molecular formula C19H14FN3O4 and a molecular weight of 367.34 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID66497751
Molecular FormulaC19H14FN3O4
Molecular Weight367.34 g/mol
Exact Mass367.10
IUPAC Name6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(-c2ccc(F)cc2)[nH]c1=O
InChIInChI=1S/C19H14FN3O4/c1-11-2-7-14(23(26)27)10-17(11)22-19(25)15-8-9-16(21-18(15)24)12-3-5-13(20)6-4-12/h2-10H,1H3,(H,21,24)(H,22,25)
InChIKeyTYBGSXIDFCHNDG-UHFFFAOYSA-N
XLogP3.65
TPSA105.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.34
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-fluoro-N-(2-methyl-5-nitrophenyl)benzamide
CID 797390
N-(2-methyl-4-nitrophenyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
CID 66497495
N-(5-fluoro-2-methylphenyl)-2-iodo-5-nitrobenzamide
CID 38898747
N-(2,5-dimethylphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497845
1-[(4-fluorophenyl)methyl]-N-(2-methyl-5-nitrophenyl)-2-oxopyridine-3-carboxamide
CID 7597772
4-fluoro-N-(2-fluoro-4-nitrophenyl)-2-methylbenzamide
CID 115745847
N-(2-bromophenyl)-6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 66497775
2,4-dibromo-N-(2-methyl-5-nitrophenyl)benzamide
CID 103885202
2,3-difluoro-N-(2-methyl-5-nitrophenyl)pyridine-4-carboxamide
CID 105380524
2,3-dimethyl-N-(2-methyl-5-nitrophenyl)benzamide
CID 30951453
2-amino-4-fluoro-N-(2-methyl-4-nitrophenyl)benzamide
CID 63110152
2-amino-5-fluoro-N-(2-methyl-4-nitrophenyl)benzamide
CID 43708503

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 66497751) is 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(-c2ccc(F)cc2)[nH]c1=O.
What is the InChIKey of 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is TYBGSXIDFCHNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3O4/c1-11-2-7-14(23(26)27)10-17(11)22-19(25)15-8-9-16(21-18(15)24)12-3-5-13(20)6-4-12/h2-10H,1H3,(H,21,24)(H,22,25).
What are the key properties of 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide?
6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 367.34 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-N-(2-methyl-5-nitrophenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 66497751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).