[(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine

C14H16FN3O — CID 114270764

IUPAC[(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine
SMILESCOc1nccc(C(NN)c2cccc(C)c2)c1F
InChIInChI=1S/C14H16FN3O/c1-9-4-3-5-10(8-9)13(18-16)11-6-7-17-14(19-2)12(11)15/h3-8,13,18H,16H2,1-2H3
InChIKeyGGEGFIUIQFBAAH-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.09
Rot. Bonds4

About [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine

[(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine (PubChem CID 114270764) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine
PubChem CID114270764
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name[(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine
SMILESCOc1nccc(C(NN)c2cccc(C)c2)c1F
InChIInChI=1S/C14H16FN3O/c1-9-4-3-5-10(8-9)13(18-16)11-6-7-17-14(19-2)12(11)15/h3-8,13,18H,16H2,1-2H3
InChIKeyGGEGFIUIQFBAAH-UHFFFAOYSA-N
XLogP2.09
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.09
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 [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine?
The IUPAC name of [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine (CID 114270764) is [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine is COc1nccc(C(NN)c2cccc(C)c2)c1F.
What is the InChIKey of [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine?
The InChIKey is GGEGFIUIQFBAAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c1-9-4-3-5-10(8-9)13(18-16)11-6-7-17-14(19-2)12(11)15/h3-8,13,18H,16H2,1-2H3.
What are the key properties of [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine?
[(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine has a molecular weight of 261.30 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-2-methoxy-4-pyridinyl)-(3-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 114270764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).