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

C15H20N4O — CID 80916406

IUPAC[5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCc1c(NN)ncnc1Oc1ccccc1C(C)C
InChIInChI=1S/C15H20N4O/c1-4-11-14(19-16)17-9-18-15(11)20-13-8-6-5-7-12(13)10(2)3/h5-10H,4,16H2,1-3H3,(H,17,18,19)
InChIKeyBRESWTBLSHVWFK-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.24
Rot. Bonds5

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

[5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine (PubChem CID 80916406) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine
PubChem CID80916406
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCc1c(NN)ncnc1Oc1ccccc1C(C)C
InChIInChI=1S/C15H20N4O/c1-4-11-14(19-16)17-9-18-15(11)20-13-8-6-5-7-12(13)10(2)3/h5-10H,4,16H2,1-3H3,(H,17,18,19)
InChIKeyBRESWTBLSHVWFK-UHFFFAOYSA-N
XLogP3.24
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.24
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

5-ethyl-N-methyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-amine
CID 80882032
[5-ethyl-6-(2-methylsulfanylphenoxy)pyrimidin-4-yl]hydrazine
CID 80925890
(5-ethyl-6-naphthalen-2-yloxypyrimidin-4-yl)hydrazine
CID 80910099
[5-ethyl-6-(5-fluoro-2-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 102989646
[5-ethyl-6-(3-methylbutan-2-yloxy)pyrimidin-4-yl]hydrazine
CID 80922712
[6-(3-bromophenoxy)-5-ethylpyrimidin-4-yl]hydrazine
CID 80915780
[5-ethyl-6-[3-(trifluoromethyl)phenoxy]pyrimidin-4-yl]hydrazine
CID 80910964
[6-[(5-chloro-3-pyridinyl)oxy]-5-ethylpyrimidin-4-yl]hydrazine
CID 80921561
(5-ethyl-6-heptoxypyrimidin-4-yl)hydrazine
CID 80910142
[5-ethyl-6-(1-ethylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116806797
5-ethyl-6-hydrazinyl-N-(2-methoxyphenyl)-N-methylpyrimidin-4-amine
CID 80908314
6-(2,3-dimethylphenoxy)-5-ethyl-N-methylpyrimidin-4-amine
CID 80864818

Frequently Asked Questions

What is the IUPAC name of [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine (CID 80916406) is [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine is CCc1c(NN)ncnc1Oc1ccccc1C(C)C.
What is the InChIKey of [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is BRESWTBLSHVWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-4-11-14(19-16)17-9-18-15(11)20-13-8-6-5-7-12(13)10(2)3/h5-10H,4,16H2,1-3H3,(H,17,18,19).
What are the key properties of [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine?
[5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 272.35 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-ethyl-6-(2-propan-2-ylphenoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80916406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).