[6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine

C14H26N6 — CID 79667141

IUPAC[6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine
SMILESCN1CCN(C)C(c2nc(NN)cc(C(C)(C)C)n2)C1
InChIInChI=1S/C14H26N6/c1-14(2,3)11-8-12(18-15)17-13(16-11)10-9-19(4)6-7-20(10)5/h8,10H,6-7,9,15H2,1-5H3,(H,16,17,18)
InChIKeyXYXDMMYNJWEUID-UHFFFAOYSA-N
MW278.40 g/mol
LogP0.98
Rot. Bonds2

About [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine

[6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine (PubChem CID 79667141) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine
PubChem CID79667141
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC Name[6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine
SMILESCN1CCN(C)C(c2nc(NN)cc(C(C)(C)C)n2)C1
InChIInChI=1S/C14H26N6/c1-14(2,3)11-8-12(18-15)17-13(16-11)10-9-19(4)6-7-20(10)5/h8,10H,6-7,9,15H2,1-5H3,(H,16,17,18)
InChIKeyXYXDMMYNJWEUID-UHFFFAOYSA-N
XLogP0.98
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 50.98
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 [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine (CID 79667141) is [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine is CN1CCN(C)C(c2nc(NN)cc(C(C)(C)C)n2)C1.
What is the InChIKey of [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is XYXDMMYNJWEUID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-14(2,3)11-8-12(18-15)17-13(16-11)10-9-19(4)6-7-20(10)5/h8,10H,6-7,9,15H2,1-5H3,(H,16,17,18).
What are the key properties of [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine?
[6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 278.40 g/mol, XLogP of 0.98, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-tert-butyl-2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 79667141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).