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

C14H16FN3O — CID 105261827

IUPAC[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2ccncc2C)c1F
InChIInChI=1S/C14H16FN3O/c1-9-8-17-7-6-10(9)14(18-16)11-4-3-5-12(19-2)13(11)15/h3-8,14,18H,16H2,1-2H3
InChIKeyJWGWEZGPZKQDRJ-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.09
Rot. Bonds4

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

[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine (PubChem CID 105261827) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine
PubChem CID105261827
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2ccncc2C)c1F
InChIInChI=1S/C14H16FN3O/c1-9-8-17-7-6-10(9)14(18-16)11-4-3-5-12(19-2)13(11)15/h3-8,14,18H,16H2,1-2H3
InChIKeyJWGWEZGPZKQDRJ-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 [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine (CID 105261827) is [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine is COc1cccc(C(NN)c2ccncc2C)c1F.
What is the InChIKey of [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine?
The InChIKey is JWGWEZGPZKQDRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c1-9-8-17-7-6-10(9)14(18-16)11-4-3-5-12(19-2)13(11)15/h3-8,14,18H,16H2,1-2H3.
What are the key properties of [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine?
[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)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 [(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105261827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).