N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide

C15H16N4O3 — CID 38009598

IUPACN'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide
SMILESCc1ccc(C)c(OCC(=O)NNC(=O)c2cnccn2)c1
InChIInChI=1S/C15H16N4O3/c1-10-3-4-11(2)13(7-10)22-9-14(20)18-19-15(21)12-8-16-5-6-17-12/h3-8H,9H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyZZQGEMTYKWKFLD-UHFFFAOYSA-N
MW300.32 g/mol
LogP0.93
Rot. Bonds4

About N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide

N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide (PubChem CID 38009598) has the molecular formula C15H16N4O3 and a molecular weight of 300.32 g/mol. Its IUPAC name is N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide
PubChem CID38009598
Molecular FormulaC15H16N4O3
Molecular Weight300.32 g/mol
Exact Mass300.12
IUPAC NameN'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide
SMILESCc1ccc(C)c(OCC(=O)NNC(=O)c2cnccn2)c1
InChIInChI=1S/C15H16N4O3/c1-10-3-4-11(2)13(7-10)22-9-14(20)18-19-15(21)12-8-16-5-6-17-12/h3-8H,9H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyZZQGEMTYKWKFLD-UHFFFAOYSA-N
XLogP0.93
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 50.93
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'-(2-chloroacetyl)-2-(2,5-dimethylphenoxy)acetohydrazide
CID 166414788
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-methoxyacetohydrazide
CID 47102429
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide
CID 26760635
N'-[2-(2,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide
CID 965967
4-tert-butyl-N'-[2-(2,5-dimethylphenoxy)acetyl]benzohydrazide
CID 3310075
N'-[2-(2,5-dimethylphenoxy)acetyl]-4-ethoxybenzohydrazide
CID 26845933
N'-[2-(2,5-dimethylphenoxy)acetyl]-2,3,4,5-tetrafluorobenzohydrazide
CID 3442692
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(2-fluorophenoxy)acetohydrazide
CID 7943429
5-chloro-N'-[2-(2,5-dimethylphenoxy)acetyl]-2-hydroxybenzohydrazide
CID 55376169
2-(2,5-dimethylphenoxy)-N-[8-[[2-(2,5-dimethylphenoxy)acetyl]amino]octyl]acetamide
CID 17233348
N'-[2-(2,5-dimethylphenoxy)acetyl]-3-methyl-4-nitrobenzohydrazide
CID 4811497
N'-[2-(2,5-dimethylphenoxy)acetyl]-3-methoxynaphthalene-2-carbohydrazide
CID 9393736

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide?
The IUPAC name of N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide (CID 38009598) is N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide.
What is the SMILES notation for N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide?
The canonical SMILES for N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide is Cc1ccc(C)c(OCC(=O)NNC(=O)c2cnccn2)c1.
What is the InChIKey of N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide?
The InChIKey is ZZQGEMTYKWKFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O3/c1-10-3-4-11(2)13(7-10)22-9-14(20)18-19-15(21)12-8-16-5-6-17-12/h3-8H,9H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide?
N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide has a molecular weight of 300.32 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,5-dimethylphenoxy)acetyl]pyrazine-2-carbohydrazide is sourced from PubChem (CID 38009598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).