[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine

C13H16N4O — CID 80917094

IUPAC[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine
SMILESCCc1ccccc1Oc1nc(NN)ncc1C
InChIInChI=1S/C13H16N4O/c1-3-10-6-4-5-7-11(10)18-12-9(2)8-15-13(16-12)17-14/h4-8H,3,14H2,1-2H3,(H,15,16,17)
InChIKeyWIYIWNUSICZTJY-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.43
Rot. Bonds4

About [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine

[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine (PubChem CID 80917094) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine
PubChem CID80917094
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine
SMILESCCc1ccccc1Oc1nc(NN)ncc1C
InChIInChI=1S/C13H16N4O/c1-3-10-6-4-5-7-11(10)18-12-9(2)8-15-13(16-12)17-14/h4-8H,3,14H2,1-2H3,(H,15,16,17)
InChIKeyWIYIWNUSICZTJY-UHFFFAOYSA-N
XLogP2.43
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.43
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

[4-(2-methoxyphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80917253
4-(2-ethylphenoxy)-5-methylpyrimidin-2-amine
CID 80875950
[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80913487
[4-(2-tert-butylphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80917311
[5-methyl-4-[(2-methyl-3-pyridinyl)oxy]pyrimidin-2-yl]hydrazine
CID 80923549
[4-(2,6-dimethoxyphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80918360
[4-(2,4-dichlorophenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80915153
4-(2-chlorophenoxy)-N-ethyl-5-methylpyrimidin-2-amine
CID 80864516
3-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-4-methylbenzonitrile
CID 107662868
[4-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol
CID 107745258
3-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-N,N-dimethylaniline
CID 80920463
[5-methyl-4-(2-propoxyethoxy)pyrimidin-2-yl]hydrazine
CID 80925219

Frequently Asked Questions

What is the IUPAC name of [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine (CID 80917094) is [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine is CCc1ccccc1Oc1nc(NN)ncc1C.
What is the InChIKey of [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine?
The InChIKey is WIYIWNUSICZTJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-3-10-6-4-5-7-11(10)18-12-9(2)8-15-13(16-12)17-14/h4-8H,3,14H2,1-2H3,(H,15,16,17).
What are the key properties of [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine?
[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine has a molecular weight of 244.30 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80917094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).