[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine

C15H13FN4O — CID 80925069

IUPAC[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine
SMILESCc1ccc(F)c(Oc2nc(NN)nc3ccccc23)c1
InChIInChI=1S/C15H13FN4O/c1-9-6-7-11(16)13(8-9)21-14-10-4-2-3-5-12(10)18-15(19-14)20-17/h2-8H,17H2,1H3,(H,18,19,20)
InChIKeyNFAMZJKKUIMALC-UHFFFAOYSA-N
MW284.29 g/mol
LogP3.16
Rot. Bonds3

About [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine

[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine (PubChem CID 80925069) has the molecular formula C15H13FN4O and a molecular weight of 284.29 g/mol. Its IUPAC name is [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine
PubChem CID80925069
Molecular FormulaC15H13FN4O
Molecular Weight284.29 g/mol
Exact Mass284.11
IUPAC Name[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine
SMILESCc1ccc(F)c(Oc2nc(NN)nc3ccccc23)c1
InChIInChI=1S/C15H13FN4O/c1-9-6-7-11(16)13(8-9)21-14-10-4-2-3-5-12(10)18-15(19-14)20-17/h2-8H,17H2,1H3,(H,18,19,20)
InChIKeyNFAMZJKKUIMALC-UHFFFAOYSA-N
XLogP3.16
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 53.16
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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Frequently Asked Questions

What is the IUPAC name of [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine?
The IUPAC name of [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine (CID 80925069) is [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine.
What is the SMILES notation for [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine?
The canonical SMILES for [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine is Cc1ccc(F)c(Oc2nc(NN)nc3ccccc23)c1.
What is the InChIKey of [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine?
The InChIKey is NFAMZJKKUIMALC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O/c1-9-6-7-11(16)13(8-9)21-14-10-4-2-3-5-12(10)18-15(19-14)20-17/h2-8H,17H2,1H3,(H,18,19,20).
What are the key properties of [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine?
[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine has a molecular weight of 284.29 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine is sourced from PubChem (CID 80925069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).