[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine

C16H22N4 — CID 62915531

IUPAC[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1ccc(Cc2nc(C)c(C(C)C)c(NN)n2)cc1
InChIInChI=1S/C16H22N4/c1-10(2)15-12(4)18-14(19-16(15)20-17)9-13-7-5-11(3)6-8-13/h5-8,10H,9,17H2,1-4H3,(H,18,19,20)
InChIKeyKGFKATZJNRIXGU-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.09
Rot. Bonds4

About [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine

[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 62915531) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID62915531
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1ccc(Cc2nc(C)c(C(C)C)c(NN)n2)cc1
InChIInChI=1S/C16H22N4/c1-10(2)15-12(4)18-14(19-16(15)20-17)9-13-7-5-11(3)6-8-13/h5-8,10H,9,17H2,1-4H3,(H,18,19,20)
InChIKeyKGFKATZJNRIXGU-UHFFFAOYSA-N
XLogP3.09
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.09
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 [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine (CID 62915531) is [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1ccc(Cc2nc(C)c(C(C)C)c(NN)n2)cc1.
What is the InChIKey of [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is KGFKATZJNRIXGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-10(2)15-12(4)18-14(19-16(15)20-17)9-13-7-5-11(3)6-8-13/h5-8,10H,9,17H2,1-4H3,(H,18,19,20).
What are the key properties of [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 270.38 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62915531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).