[2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine

C14H14N6 — CID 62251648

IUPAC[2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine
SMILESCn1cc(-c2nc(NN)cc(-c3ccccc3)n2)cn1
InChIInChI=1S/C14H14N6/c1-20-9-11(8-16-20)14-17-12(7-13(18-14)19-15)10-5-3-2-4-6-10/h2-9H,15H2,1H3,(H,17,18,19)
InChIKeyZDXHYLAVHNIOKM-UHFFFAOYSA-N
MW266.31 g/mol
LogP1.83
Rot. Bonds3

About [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine

[2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine (PubChem CID 62251648) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine
PubChem CID62251648
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC Name[2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine
SMILESCn1cc(-c2nc(NN)cc(-c3ccccc3)n2)cn1
InChIInChI=1S/C14H14N6/c1-20-9-11(8-16-20)14-17-12(7-13(18-14)19-15)10-5-3-2-4-6-10/h2-9H,15H2,1H3,(H,17,18,19)
InChIKeyZDXHYLAVHNIOKM-UHFFFAOYSA-N
XLogP1.83
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 ≤ 51.83
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-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine (CID 62251648) is [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine is Cn1cc(-c2nc(NN)cc(-c3ccccc3)n2)cn1.
What is the InChIKey of [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine?
The InChIKey is ZDXHYLAVHNIOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6/c1-20-9-11(8-16-20)14-17-12(7-13(18-14)19-15)10-5-3-2-4-6-10/h2-9H,15H2,1H3,(H,17,18,19).
What are the key properties of [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine?
[2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine has a molecular weight of 266.31 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62251648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).