[5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine

C15H20N4O — CID 80915965

IUPAC[5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine
SMILESCc1ccc(C(C)C)c(Oc2ncnc(NN)c2C)c1
InChIInChI=1S/C15H20N4O/c1-9(2)12-6-5-10(3)7-13(12)20-15-11(4)14(19-16)17-8-18-15/h5-9H,16H2,1-4H3,(H,17,18,19)
InChIKeyLJNXVNYQAFRKPC-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.29
Rot. Bonds4

About [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine

[5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine (PubChem CID 80915965) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine
PubChem CID80915965
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine
SMILESCc1ccc(C(C)C)c(Oc2ncnc(NN)c2C)c1
InChIInChI=1S/C15H20N4O/c1-9(2)12-6-5-10(3)7-13(12)20-15-11(4)14(19-16)17-8-18-15/h5-9H,16H2,1-4H3,(H,17,18,19)
InChIKeyLJNXVNYQAFRKPC-UHFFFAOYSA-N
XLogP3.29
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 ≤ 53.29
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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Related Compounds

[6-(2-methoxy-4-methylphenoxy)-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80909009
[5-propan-2-yl-6-(2,3,5-trimethylphenoxy)pyrimidin-4-yl]hydrazine
CID 80910696
[6-(2-methoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80916535
[6-(4-bromo-2-methylphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80924994
[6-(2,5-difluorophenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80924404
[4-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-2-yl]hydrazine
CID 80915964
[6-(3,5-dimethoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80917651
2,5-dimethyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-amine
CID 80864721
[6-(2-bromo-4-methoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 104708877
[6-(3-ethoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80930752
5-bromo-4-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyridin-3-amine
CID 104507226
6-(2,5-dimethylphenoxy)-N-ethyl-5-methylpyrimidin-4-amine
CID 80864233

Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine (CID 80915965) is [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine is Cc1ccc(C(C)C)c(Oc2ncnc(NN)c2C)c1.
What is the InChIKey of [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is LJNXVNYQAFRKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-9(2)12-6-5-10(3)7-13(12)20-15-11(4)14(19-16)17-8-18-15/h5-9H,16H2,1-4H3,(H,17,18,19).
What are the key properties of [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
[5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 272.35 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80915965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).