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

C13H13N7 — CID 106716187

IUPAC[6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine
SMILESCn1cc(-c2cc(NN)nc(-c3ccncc3)n2)cn1
InChIInChI=1S/C13H13N7/c1-20-8-10(7-16-20)11-6-12(19-14)18-13(17-11)9-2-4-15-5-3-9/h2-8H,14H2,1H3,(H,17,18,19)
InChIKeyGWDFFVLFCFHULO-UHFFFAOYSA-N
MW267.30 g/mol
LogP1.22
Rot. Bonds3

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

[6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine (PubChem CID 106716187) has the molecular formula C13H13N7 and a molecular weight of 267.30 g/mol. Its IUPAC name is [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine
PubChem CID106716187
Molecular FormulaC13H13N7
Molecular Weight267.30 g/mol
Exact Mass267.12
IUPAC Name[6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine
SMILESCn1cc(-c2cc(NN)nc(-c3ccncc3)n2)cn1
InChIInChI=1S/C13H13N7/c1-20-8-10(7-16-20)11-6-12(19-14)18-13(17-11)9-2-4-15-5-3-9/h2-8H,14H2,1H3,(H,17,18,19)
InChIKeyGWDFFVLFCFHULO-UHFFFAOYSA-N
XLogP1.22
TPSA94.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine (CID 106716187) is [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine is Cn1cc(-c2cc(NN)nc(-c3ccncc3)n2)cn1.
What is the InChIKey of [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine?
The InChIKey is GWDFFVLFCFHULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N7/c1-20-8-10(7-16-20)11-6-12(19-14)18-13(17-11)9-2-4-15-5-3-9/h2-8H,14H2,1H3,(H,17,18,19).
What are the key properties of [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine?
[6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine has a molecular weight of 267.30 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1-methylpyrazol-4-yl)-2-pyridin-4-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 106716187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).