[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine

C12H18N6 — CID 80903201

IUPAC[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCCc1nccn1-c1nc(C)nc(NN)c1C
InChIInChI=1S/C12H18N6/c1-4-5-10-14-6-7-18(10)12-8(2)11(17-13)15-9(3)16-12/h6-7H,4-5,13H2,1-3H3,(H,15,16,17)
InChIKeyDMOSJTUJANCQGI-UHFFFAOYSA-N
MW246.32 g/mol
LogP1.52
Rot. Bonds4

About [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine

[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 80903201) has the molecular formula C12H18N6 and a molecular weight of 246.32 g/mol. Its IUPAC name is [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID80903201
Molecular FormulaC12H18N6
Molecular Weight246.32 g/mol
Exact Mass246.16
IUPAC Name[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCCc1nccn1-c1nc(C)nc(NN)c1C
InChIInChI=1S/C12H18N6/c1-4-5-10-14-6-7-18(10)12-8(2)11(17-13)15-9(3)16-12/h6-7H,4-5,13H2,1-3H3,(H,15,16,17)
InChIKeyDMOSJTUJANCQGI-UHFFFAOYSA-N
XLogP1.52
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.32
LogP ≤ 51.52
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 [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine (CID 80903201) is [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine is CCCc1nccn1-c1nc(C)nc(NN)c1C.
What is the InChIKey of [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is DMOSJTUJANCQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6/c1-4-5-10-14-6-7-18(10)12-8(2)11(17-13)15-9(3)16-12/h6-7H,4-5,13H2,1-3H3,(H,15,16,17).
What are the key properties of [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine?
[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 246.32 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80903201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).