[(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine

C12H15N5 — CID 107505050

IUPAC[(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine
SMILESCc1cc(C(NN)c2cncnc2)cc(C)n1
InChIInChI=1S/C12H15N5/c1-8-3-10(4-9(2)16-8)12(17-13)11-5-14-7-15-6-11/h3-7,12,17H,13H2,1-2H3
InChIKeyYZZNHBXSIQAKGD-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.04
Rot. Bonds3

About [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine

[(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine (PubChem CID 107505050) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine
PubChem CID107505050
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name[(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine
SMILESCc1cc(C(NN)c2cncnc2)cc(C)n1
InChIInChI=1S/C12H15N5/c1-8-3-10(4-9(2)16-8)12(17-13)11-5-14-7-15-6-11/h3-7,12,17H,13H2,1-2H3
InChIKeyYZZNHBXSIQAKGD-UHFFFAOYSA-N
XLogP1.04
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.04
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'}

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Frequently Asked Questions

What is the IUPAC name of [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine?
The IUPAC name of [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine (CID 107505050) is [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine.
What is the SMILES notation for [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine?
The canonical SMILES for [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine is Cc1cc(C(NN)c2cncnc2)cc(C)n1.
What is the InChIKey of [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine?
The InChIKey is YZZNHBXSIQAKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-8-3-10(4-9(2)16-8)12(17-13)11-5-14-7-15-6-11/h3-7,12,17H,13H2,1-2H3.
What are the key properties of [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine?
[(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine has a molecular weight of 229.29 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,6-dimethyl-4-pyridinyl)-pyrimidin-5-ylmethyl]hydrazine is sourced from PubChem (CID 107505050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).