N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide

C14H14N4O4 — CID 750783

IUPACN'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide
SMILESCOc1cccc(OCC(=O)NNC(=O)c2cnccn2)c1
InChIInChI=1S/C14H14N4O4/c1-21-10-3-2-4-11(7-10)22-9-13(19)17-18-14(20)12-8-15-5-6-16-12/h2-8H,9H2,1H3,(H,17,19)(H,18,20)
InChIKeyZVZWWYIKKWSYQM-UHFFFAOYSA-N
MW302.29 g/mol
LogP0.33
Rot. Bonds5

About N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide

N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide (PubChem CID 750783) has the molecular formula C14H14N4O4 and a molecular weight of 302.29 g/mol. Its IUPAC name is N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide
PubChem CID750783
Molecular FormulaC14H14N4O4
Molecular Weight302.29 g/mol
Exact Mass302.10
IUPAC NameN'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide
SMILESCOc1cccc(OCC(=O)NNC(=O)c2cnccn2)c1
InChIInChI=1S/C14H14N4O4/c1-21-10-3-2-4-11(7-10)22-9-13(19)17-18-14(20)12-8-15-5-6-16-12/h2-8H,9H2,1H3,(H,17,19)(H,18,20)
InChIKeyZVZWWYIKKWSYQM-UHFFFAOYSA-N
XLogP0.33
TPSA102.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.29
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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
N'-[2-(2-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide
CID 756597
N'-[2-(4-chlorophenoxy)acetyl]-2-pyrazinecarbohydrazide
CID 793936
N'-[2-[3-(trifluoromethyl)phenoxy]acetyl]pyrazine-2-carbohydrazide
CID 4826934
N'-[2-(2,4-dichlorophenoxy)propanoyl]pyrazine-2-carbohydrazide
CID 3120244
N'-[2-(2-bromo-4-fluorophenoxy)acetyl]pyrazine-2-carbohydrazide
CID 18159793
N'-[2-(2-fluorophenoxy)propanoyl]-5-methylpyrazine-2-carbohydrazide
CID 18205783
N'-[2-(4-fluorophenoxy)acetyl]-5-methylpyrazine-2-carbohydrazide
CID 22830725
N'-[2-(2-chloro-4-fluorophenoxy)acetyl]pyrazine-2-carbohydrazide
CID 41879392
N'-[2-(2-fluorophenoxy)propanoyl]pyrazine-2-carbohydrazide
CID 45765666
3-amino-N'-[2-(2-fluorophenoxy)propanoyl]pyrazine-2-carbohydrazide
CID 46689729
N'-[2-(4-fluorophenoxy)propanoyl]pyrazine-2-carbohydrazide
CID 51161375

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide?
The IUPAC name of N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide (CID 750783) is N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide.
What is the SMILES notation for N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide?
The canonical SMILES for N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide is COc1cccc(OCC(=O)NNC(=O)c2cnccn2)c1.
What is the InChIKey of N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide?
The InChIKey is ZVZWWYIKKWSYQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O4/c1-21-10-3-2-4-11(7-10)22-9-13(19)17-18-14(20)12-8-15-5-6-16-12/h2-8H,9H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide?
N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide has a molecular weight of 302.29 g/mol, XLogP of 0.33, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-methoxyphenoxy)acetyl]pyrazine-2-carbohydrazide is sourced from PubChem (CID 750783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).