[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine

C13H16N4O — CID 80917231

IUPAC[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine
SMILESCc1ccc(C)c(Oc2cncc(NN)n2)c1C
InChIInChI=1S/C13H16N4O/c1-8-4-5-9(2)13(10(8)3)18-12-7-15-6-11(16-12)17-14/h4-7H,14H2,1-3H3,(H,16,17)
InChIKeyIAOFHKFJWGNQCL-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.48
Rot. Bonds3

About [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine

[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine (PubChem CID 80917231) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine
PubChem CID80917231
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine
SMILESCc1ccc(C)c(Oc2cncc(NN)n2)c1C
InChIInChI=1S/C13H16N4O/c1-8-4-5-9(2)13(10(8)3)18-12-7-15-6-11(16-12)17-14/h4-7H,14H2,1-3H3,(H,16,17)
InChIKeyIAOFHKFJWGNQCL-UHFFFAOYSA-N
XLogP2.48
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[6-(2,6-dimethoxyphenoxy)pyrazin-2-yl]hydrazine
CID 80917602
[2-methylsulfanyl-6-(2,3,6-trimethylphenoxy)pyrimidin-4-yl]hydrazine
CID 80916728
N-[[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]methyl]cyclopropanamine
CID 66451614
[6-(2-bromo-4-methylphenoxy)pyrazin-2-yl]hydrazine
CID 80912756
[6-(4-bromo-2-methyl-6-nitrophenoxy)pyrazin-2-yl]hydrazine
CID 80923460
[6-(5-methyl-2-nitrophenoxy)pyrazin-2-yl]hydrazine
CID 80920526
4-methyl-6-(2,3,6-trimethylphenoxy)pyrimidin-2-amine
CID 80875832
[6-(4-bromo-2-chlorophenoxy)pyrazin-2-yl]hydrazine
CID 80916570
[6-(4-chloro-3-fluorophenoxy)pyrazin-2-yl]hydrazine
CID 82719274
5-bromo-4-(2,3,6-trimethylphenoxy)pyridin-3-amine
CID 103518744
3-chloro-6-(2,3,6-trimethylphenoxy)pyridazine
CID 6400993
[6-(2-tert-butyl-4-ethylphenoxy)pyrazin-2-yl]hydrazine
CID 80909040

Frequently Asked Questions

What is the IUPAC name of [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine?
The IUPAC name of [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine (CID 80917231) is [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine?
The canonical SMILES for [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine is Cc1ccc(C)c(Oc2cncc(NN)n2)c1C.
What is the InChIKey of [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine?
The InChIKey is IAOFHKFJWGNQCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-8-4-5-9(2)13(10(8)3)18-12-7-15-6-11(16-12)17-14/h4-7H,14H2,1-3H3,(H,16,17).
What are the key properties of [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine?
[6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine has a molecular weight of 244.30 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3,6-trimethylphenoxy)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 80917231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).