[6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine

C15H20N4O — CID 80656225

IUPAC[6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine
SMILESCc1cc(C)c(OCc2nc(C)cc(NN)n2)c(C)c1
InChIInChI=1S/C15H20N4O/c1-9-5-10(2)15(11(3)6-9)20-8-14-17-12(4)7-13(18-14)19-16/h5-7H,8,16H2,1-4H3,(H,17,18,19)
InChIKeyWLHPWRMDVZJHCL-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.57
Rot. Bonds4

About [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine

[6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine (PubChem CID 80656225) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine
PubChem CID80656225
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine
SMILESCc1cc(C)c(OCc2nc(C)cc(NN)n2)c(C)c1
InChIInChI=1S/C15H20N4O/c1-9-5-10(2)15(11(3)6-9)20-8-14-17-12(4)7-13(18-14)19-16/h5-7H,8,16H2,1-4H3,(H,17,18,19)
InChIKeyWLHPWRMDVZJHCL-UHFFFAOYSA-N
XLogP2.57
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.57
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 [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine (CID 80656225) is [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine is Cc1cc(C)c(OCc2nc(C)cc(NN)n2)c(C)c1.
What is the InChIKey of [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine?
The InChIKey is WLHPWRMDVZJHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-9-5-10(2)15(11(3)6-9)20-8-14-17-12(4)7-13(18-14)19-16/h5-7H,8,16H2,1-4H3,(H,17,18,19).
What are the key properties of [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine?
[6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine has a molecular weight of 272.35 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-2-[(2,4,6-trimethylphenoxy)methyl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80656225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).