N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide

C13H12FN3O2 — CID 118039703

IUPACN'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide
SMILESCn1cc(C(=O)NNc2ccccc2F)ccc1=O
InChIInChI=1S/C13H12FN3O2/c1-17-8-9(6-7-12(17)18)13(19)16-15-11-5-3-2-4-10(11)14/h2-8,15H,1H3,(H,16,19)
InChIKeySFFUANBDSFOLMG-UHFFFAOYSA-N
MW261.26 g/mol
LogP1.28
Rot. Bonds3

About N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide

N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide (PubChem CID 118039703) has the molecular formula C13H12FN3O2 and a molecular weight of 261.26 g/mol. Its IUPAC name is N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide
PubChem CID118039703
Molecular FormulaC13H12FN3O2
Molecular Weight261.26 g/mol
Exact Mass261.09
IUPAC NameN'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide
SMILESCn1cc(C(=O)NNc2ccccc2F)ccc1=O
InChIInChI=1S/C13H12FN3O2/c1-17-8-9(6-7-12(17)18)13(19)16-15-11-5-3-2-4-10(11)14/h2-8,15H,1H3,(H,16,19)
InChIKeySFFUANBDSFOLMG-UHFFFAOYSA-N
XLogP1.28
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-chloro-3-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide
CID 118039643
ethyl 2-[(1-methyl-6-oxopyridine-3-carbonyl)amino]benzoate
CID 110693143
1-methyl-6-oxo-N-trimethylsilylpyridine-3-carboxamide
CID 610623
1-benzyl-N-(2-fluorophenyl)-6-oxopyridine-3-carboxamide
CID 8670963
N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 26844020
N-[(2-fluorophenyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 71144192
N-[(1S)-1-(2-methoxyphenyl)ethyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 97313653
N-(3-acetylphenyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 110693091
3-(2-fluorophenyl)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
CID 47067445
1-methyl-6-oxo-N-[(1-phenylcyclopropyl)methyl]pyridine-3-carboxamide
CID 56813252
N-[(2S,3R)-2-(3,4-difluorophenyl)-1-methylpyrrolidin-3-yl]-1-methyl-6-oxopyridine-3-carboxamide
CID 99850796
N-(2-chlorophenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 26844026

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide?
The IUPAC name of N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide (CID 118039703) is N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide.
What is the SMILES notation for N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide?
The canonical SMILES for N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide is Cn1cc(C(=O)NNc2ccccc2F)ccc1=O.
What is the InChIKey of N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide?
The InChIKey is SFFUANBDSFOLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2/c1-17-8-9(6-7-12(17)18)13(19)16-15-11-5-3-2-4-10(11)14/h2-8,15H,1H3,(H,16,19).
What are the key properties of N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide?
N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide has a molecular weight of 261.26 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide is sourced from PubChem (CID 118039703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).