[6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine

C11H11FN4O — CID 80916968

IUPAC[6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(Oc2cccc(F)c2)n1
InChIInChI=1S/C11H11FN4O/c1-7-14-10(16-13)6-11(15-7)17-9-4-2-3-8(12)5-9/h2-6H,13H2,1H3,(H,14,15,16)
InChIKeyMZINPFCQYNMJFZ-UHFFFAOYSA-N
MW234.23 g/mol
LogP2.00
Rot. Bonds3

About [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine

[6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine (PubChem CID 80916968) has the molecular formula C11H11FN4O and a molecular weight of 234.23 g/mol. Its IUPAC name is [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine
PubChem CID80916968
Molecular FormulaC11H11FN4O
Molecular Weight234.23 g/mol
Exact Mass234.09
IUPAC Name[6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(Oc2cccc(F)c2)n1
InChIInChI=1S/C11H11FN4O/c1-7-14-10(16-13)6-11(15-7)17-9-4-2-3-8(12)5-9/h2-6H,13H2,1H3,(H,14,15,16)
InChIKeyMZINPFCQYNMJFZ-UHFFFAOYSA-N
XLogP2.00
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 52.00
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

[2-tert-butyl-6-(3-fluorophenoxy)pyrimidin-4-yl]hydrazine
CID 80979164
[6-(3-fluorophenoxy)-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776384
[6-(3,4-dimethylphenoxy)-2-methylpyrimidin-4-yl]hydrazine
CID 80915052
6-(3-fluorophenoxy)-2-methylpyrimidine-4-carboxylic acid
CID 116820280
4-N-ethyl-6-(3-fluorophenoxy)pyrimidine-2,4-diamine
CID 80870028
2-tert-butyl-6-(3-fluorophenoxy)-N-methylpyrimidin-4-amine
CID 80965315
[6-(3-methylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721263
[2-cyclopropyl-6-(3-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 80969262
[2-methyl-6-[4-(2-methylbutan-2-yl)phenoxy]pyrimidin-4-yl]hydrazine
CID 80910663
[6-(3-methylphenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947768
N-ethyl-2-methyl-6-[3-(trifluoromethyl)phenoxy]pyrimidin-4-amine
CID 80874519
3-(6-hydrazinyl-2-methylsulfanylpyrimidin-4-yl)oxy-N,N-dimethylaniline
CID 80920296

Frequently Asked Questions

What is the IUPAC name of [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine (CID 80916968) is [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine is Cc1nc(NN)cc(Oc2cccc(F)c2)n1.
What is the InChIKey of [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine?
The InChIKey is MZINPFCQYNMJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O/c1-7-14-10(16-13)6-11(15-7)17-9-4-2-3-8(12)5-9/h2-6H,13H2,1H3,(H,14,15,16).
What are the key properties of [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine?
[6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine has a molecular weight of 234.23 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-fluorophenoxy)-2-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80916968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).