[2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine

C17H24N4 — CID 62251261

IUPAC[2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine
SMILESCc1cc(C(C)(C)C)cc(C)c1Cc1nccc(NN)n1
InChIInChI=1S/C17H24N4/c1-11-8-13(17(3,4)5)9-12(2)14(11)10-16-19-7-6-15(20-16)21-18/h6-9H,10,18H2,1-5H3,(H,19,20,21)
InChIKeyYZZKUNDYBQYCCW-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.27
Rot. Bonds3

About [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine

[2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine (PubChem CID 62251261) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine
PubChem CID62251261
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name[2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine
SMILESCc1cc(C(C)(C)C)cc(C)c1Cc1nccc(NN)n1
InChIInChI=1S/C17H24N4/c1-11-8-13(17(3,4)5)9-12(2)14(11)10-16-19-7-6-15(20-16)21-18/h6-9H,10,18H2,1-5H3,(H,19,20,21)
InChIKeyYZZKUNDYBQYCCW-UHFFFAOYSA-N
XLogP3.27
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine (CID 62251261) is [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine is Cc1cc(C(C)(C)C)cc(C)c1Cc1nccc(NN)n1.
What is the InChIKey of [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine?
The InChIKey is YZZKUNDYBQYCCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-11-8-13(17(3,4)5)9-12(2)14(11)10-16-19-7-6-15(20-16)21-18/h6-9H,10,18H2,1-5H3,(H,19,20,21).
What are the key properties of [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine?
[2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine has a molecular weight of 284.41 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62251261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).