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

C14H18N4O2 — CID 80917904

IUPAC[5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCCOc1ccccc1Oc1ncnc(NN)c1C
InChIInChI=1S/C14H18N4O2/c1-3-8-19-11-6-4-5-7-12(11)20-14-10(2)13(18-15)16-9-17-14/h4-7,9H,3,8,15H2,1-2H3,(H,16,17,18)
InChIKeyYDEMQSXFTDHATH-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.65
Rot. Bonds6

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

[5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine (PubChem CID 80917904) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine
PubChem CID80917904
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name[5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCCOc1ccccc1Oc1ncnc(NN)c1C
InChIInChI=1S/C14H18N4O2/c1-3-8-19-11-6-4-5-7-12(11)20-14-10(2)13(18-15)16-9-17-14/h4-7,9H,3,8,15H2,1-2H3,(H,16,17,18)
InChIKeyYDEMQSXFTDHATH-UHFFFAOYSA-N
XLogP2.65
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.65
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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Related Compounds

[6-(2-methoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80916535
[6-(4-ethylphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80915337
[6-(3-ethoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80930752
[6-(2,5-difluorophenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80924404
[6-(4-bromo-2-methylphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80924994
4-chloro-5-propan-2-yl-6-(2-propoxyphenoxy)pyrimidine
CID 63735708
2-ethyl-5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-amine
CID 80988350
1-(3-bromopropoxy)-2-propoxybenzene
CID 43135429
[5-methyl-6-(3-methylbutoxy)pyrimidin-4-yl]hydrazine
CID 80910715
[6-(3,5-dimethoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80917651
[5-methyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116806862
[6-(2-bromo-4-methoxyphenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 104708877

Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine (CID 80917904) is [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine is CCCOc1ccccc1Oc1ncnc(NN)c1C.
What is the InChIKey of [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is YDEMQSXFTDHATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-3-8-19-11-6-4-5-7-12(11)20-14-10(2)13(18-15)16-9-17-14/h4-7,9H,3,8,15H2,1-2H3,(H,16,17,18).
What are the key properties of [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine?
[5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 274.32 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-(2-propoxyphenoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80917904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).