[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine

C17H18N4 — CID 107357864

IUPAC[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cnc3ccccc3n2)c(C)c1
InChIInChI=1S/C17H18N4/c1-11-7-8-13(12(2)9-11)17(21-18)16-10-19-14-5-3-4-6-15(14)20-16/h3-10,17,21H,18H2,1-2H3
InChIKeyULBHCSISOTULBH-UHFFFAOYSA-N
MW278.36 g/mol
LogP2.80
Rot. Bonds3

About [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine

[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine (PubChem CID 107357864) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine
PubChem CID107357864
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC Name[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cnc3ccccc3n2)c(C)c1
InChIInChI=1S/C17H18N4/c1-11-7-8-13(12(2)9-11)17(21-18)16-10-19-14-5-3-4-6-15(14)20-16/h3-10,17,21H,18H2,1-2H3
InChIKeyULBHCSISOTULBH-UHFFFAOYSA-N
XLogP2.80
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(2-fluoro-5-methylphenyl)-quinoxalin-2-ylmethyl]hydrazine
CID 107357861
[(2,4-dimethylphenyl)-(2-iodophenyl)methyl]hydrazine
CID 105304663
(2-fluoro-5-methylphenyl)-quinoxalin-2-ylmethanamine
CID 107357097
[(2,4-dimethylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228647
[(3,4-difluorophenyl)-quinoxalin-2-ylmethyl]hydrazine
CID 107357865
(4-fluoro-2-methylphenyl)-quinoxalin-2-ylmethanamine
CID 107357093
[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105304674
1-(3,5-dimethylphenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107356945
(2,2-dimethyl-1-quinoxalin-2-ylpropyl)hydrazine
CID 107357866
[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105304599
(2,4-dimethylphenyl)-quinolin-2-ylmethanamine
CID 63222466
N-[(3-methylphenyl)-quinoxalin-2-ylmethyl]ethanamine
CID 107356920

Frequently Asked Questions

What is the IUPAC name of [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine?
The IUPAC name of [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine (CID 107357864) is [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine.
What is the SMILES notation for [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine?
The canonical SMILES for [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine is Cc1ccc(C(NN)c2cnc3ccccc3n2)c(C)c1.
What is the InChIKey of [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine?
The InChIKey is ULBHCSISOTULBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-11-7-8-13(12(2)9-11)17(21-18)16-10-19-14-5-3-4-6-15(14)20-16/h3-10,17,21H,18H2,1-2H3.
What are the key properties of [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine?
[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine has a molecular weight of 278.36 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine is sourced from PubChem (CID 107357864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).