[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine

C14H14N6 — CID 80900186

IUPAC[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(-n2cc(-c3ccccc3)cn2)n1
InChIInChI=1S/C14H14N6/c1-10-17-13(19-15)7-14(18-10)20-9-12(8-16-20)11-5-3-2-4-6-11/h2-9H,15H2,1H3,(H,17,18,19)
InChIKeyOXHPGKQXSRAPMW-UHFFFAOYSA-N
MW266.31 g/mol
LogP1.92
Rot. Bonds3

About [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine

[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 80900186) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID80900186
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC Name[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(-n2cc(-c3ccccc3)cn2)n1
InChIInChI=1S/C14H14N6/c1-10-17-13(19-15)7-14(18-10)20-9-12(8-16-20)11-5-3-2-4-6-11/h2-9H,15H2,1H3,(H,17,18,19)
InChIKeyOXHPGKQXSRAPMW-UHFFFAOYSA-N
XLogP1.92
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine (CID 80900186) is [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine is Cc1nc(NN)cc(-n2cc(-c3ccccc3)cn2)n1.
What is the InChIKey of [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is OXHPGKQXSRAPMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6/c1-10-17-13(19-15)7-14(18-10)20-9-12(8-16-20)11-5-3-2-4-6-11/h2-9H,15H2,1H3,(H,17,18,19).
What are the key properties of [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine?
[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 266.31 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80900186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).