N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide

C15H15FN4O3 — CID 51161385

IUPACN'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide
SMILESCc1cnc(C(=O)NNC(=O)C(C)Oc2ccc(F)cc2)cn1
InChIInChI=1S/C15H15FN4O3/c1-9-7-18-13(8-17-9)15(22)20-19-14(21)10(2)23-12-5-3-11(16)4-6-12/h3-8,10H,1-2H3,(H,19,21)(H,20,22)
InChIKeyLOKZCKXZKHRWTN-UHFFFAOYSA-N
MW318.31 g/mol
LogP1.15
Rot. Bonds4

About N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide

N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide (PubChem CID 51161385) has the molecular formula C15H15FN4O3 and a molecular weight of 318.31 g/mol. Its IUPAC name is N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide
PubChem CID51161385
Molecular FormulaC15H15FN4O3
Molecular Weight318.31 g/mol
Exact Mass318.11
IUPAC NameN'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide
SMILESCc1cnc(C(=O)NNC(=O)C(C)Oc2ccc(F)cc2)cn1
InChIInChI=1S/C15H15FN4O3/c1-9-7-18-13(8-17-9)15(22)20-19-14(21)10(2)23-12-5-3-11(16)4-6-12/h3-8,10H,1-2H3,(H,19,21)(H,20,22)
InChIKeyLOKZCKXZKHRWTN-UHFFFAOYSA-N
XLogP1.15
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.31
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]-2-pyrazinecarbohydrazide
CID 934383
Pyrazine-2-carboxylic acid [2-(2-p-tolyloxy-acetylamino)-ethyl]-amide
CID 6498568
N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-2-pyrazinecarbohydrazide
CID 7021979
2-(3-methoxyphenoxy)-N'-(2-pyrazinylcarbonyl)acetohydrazide
CID 750783
N'-[2-(4-bromo-2-methylphenoxy)-1-oxoethyl]-2-pyrazinecarbohydrazide
CID 1224313
N''-[2-(2-bromo-4-ethyl-phenoxy)acetyl]pyrazinohydrazide
CID 2958821
2-(4-chloro-2-methylphenoxy)-N'-(2-pyrazinylcarbonyl)acetohydrazide
CID 751040
N'-[2-(2-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide
CID 756597
N'-(2-phenoxypropanoyl)pyridine-2-carbohydrazide
CID 3743145
(E)-N'-(4-ethoxybenzylidene)pyrazine-2-carbohydrazide
CID 6867033
N-[(E)-(3-ethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 44613929
N-[2-(4-fluorophenoxy)ethyl]-1-(pyrazine-2-carbonyl)azetidine-3-carboxamide
CID 71785645

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide?
The IUPAC name of N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide (CID 51161385) is N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide.
What is the SMILES notation for N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide?
The canonical SMILES for N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide is Cc1cnc(C(=O)NNC(=O)C(C)Oc2ccc(F)cc2)cn1.
What is the InChIKey of N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide?
The InChIKey is LOKZCKXZKHRWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN4O3/c1-9-7-18-13(8-17-9)15(22)20-19-14(21)10(2)23-12-5-3-11(16)4-6-12/h3-8,10H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide?
N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide has a molecular weight of 318.31 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide is sourced from PubChem (CID 51161385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).