[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine

C14H16FN3O — CID 105288044

IUPAC[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)c2cncc(F)c2)cc1
InChIInChI=1S/C14H16FN3O/c1-2-19-13-5-3-10(4-6-13)14(18-16)11-7-12(15)9-17-8-11/h3-9,14,18H,2,16H2,1H3
InChIKeyXYZANCKNJMEERQ-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.17
Rot. Bonds5

About [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine

[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine (PubChem CID 105288044) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
PubChem CID105288044
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)c2cncc(F)c2)cc1
InChIInChI=1S/C14H16FN3O/c1-2-19-13-5-3-10(4-6-13)14(18-16)11-7-12(15)9-17-8-11/h3-9,14,18H,2,16H2,1H3
InChIKeyXYZANCKNJMEERQ-UHFFFAOYSA-N
XLogP2.17
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine (CID 105288044) is [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine is CCOc1ccc(C(NN)c2cncc(F)c2)cc1.
What is the InChIKey of [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine?
The InChIKey is XYZANCKNJMEERQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c1-2-19-13-5-3-10(4-6-13)14(18-16)11-7-12(15)9-17-8-11/h3-9,14,18H,2,16H2,1H3.
What are the key properties of [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine?
[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine has a molecular weight of 261.30 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105288044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).