[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine

C15H18FN3O — CID 105266471

IUPAC[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ncc(C)cc2C)cc1F
InChIInChI=1S/C15H18FN3O/c1-9-6-10(2)14(18-8-9)15(19-17)11-4-5-13(20-3)12(16)7-11/h4-8,15,19H,17H2,1-3H3
InChIKeyGWKDEWITCBSOBB-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.40
Rot. Bonds4

About [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine

[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine (PubChem CID 105266471) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
PubChem CID105266471
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC Name[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ncc(C)cc2C)cc1F
InChIInChI=1S/C15H18FN3O/c1-9-6-10(2)14(18-8-9)15(19-17)11-4-5-13(20-3)12(16)7-11/h4-8,15,19H,17H2,1-3H3
InChIKeyGWKDEWITCBSOBB-UHFFFAOYSA-N
XLogP2.40
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.40
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 [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine (CID 105266471) is [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine is COc1ccc(C(NN)c2ncc(C)cc2C)cc1F.
What is the InChIKey of [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine?
The InChIKey is GWKDEWITCBSOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c1-9-6-10(2)14(18-8-9)15(19-17)11-4-5-13(20-3)12(16)7-11/h4-8,15,19H,17H2,1-3H3.
What are the key properties of [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine?
[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine has a molecular weight of 275.33 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105266471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).