[(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine

C14H13FN6 — CID 105248565

IUPAC[(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
SMILESNNC(c1ccc(F)cn1)c1cnnn1-c1ccccc1
InChIInChI=1S/C14H13FN6/c15-10-6-7-12(17-8-10)14(19-16)13-9-18-20-21(13)11-4-2-1-3-5-11/h1-9,14,19H,16H2
InChIKeyYAEQBLFBKMPWLF-UHFFFAOYSA-N
MW284.30 g/mol
LogP1.35
Rot. Bonds4

About [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine

[(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine (PubChem CID 105248565) has the molecular formula C14H13FN6 and a molecular weight of 284.30 g/mol. Its IUPAC name is [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
PubChem CID105248565
Molecular FormulaC14H13FN6
Molecular Weight284.30 g/mol
Exact Mass284.12
IUPAC Name[(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
SMILESNNC(c1ccc(F)cn1)c1cnnn1-c1ccccc1
InChIInChI=1S/C14H13FN6/c15-10-6-7-12(17-8-10)14(19-16)13-9-18-20-21(13)11-4-2-1-3-5-11/h1-9,14,19H,16H2
InChIKeyYAEQBLFBKMPWLF-UHFFFAOYSA-N
XLogP1.35
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.30
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methanamine
CID 114688571
[(2-methylpyrimidin-4-yl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 105260678
4-[hydrazinyl-(3-phenyltriazol-4-yl)methyl]-1-methylpyrazol-5-amine
CID 105231007
[(2-chloro-4-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 105252908
1-(5-fluoro-2-pyridinyl)-N-methyl-1-(3-methyltriazol-4-yl)methanamine
CID 114688577
1-(3-fluoro-2-pyridinyl)-N-methyl-1-(3-phenyltriazol-4-yl)methanamine
CID 114688838
2-(4-fluorophenyl)-1-(3-phenyltriazol-4-yl)ethanol
CID 114686314
N-methyl-1-(2-methylpyrimidin-4-yl)-1-(3-phenyltriazol-4-yl)methanamine
CID 114688914
N-methyl-1-(6-methyl-2-pyridinyl)-1-(3-phenyltriazol-4-yl)methanamine
CID 114687713
2,2-difluoro-N-methyl-1-(3-phenyltriazol-4-yl)ethanamine
CID 103517148
[(3,4-difluorophenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
CID 105248376
1-(3-phenyltriazol-4-yl)butylhydrazine
CID 105202328

Frequently Asked Questions

What is the IUPAC name of [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine (CID 105248565) is [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine is NNC(c1ccc(F)cn1)c1cnnn1-c1ccccc1.
What is the InChIKey of [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
The InChIKey is YAEQBLFBKMPWLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN6/c15-10-6-7-12(17-8-10)14(19-16)13-9-18-20-21(13)11-4-2-1-3-5-11/h1-9,14,19H,16H2.
What are the key properties of [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
[(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine has a molecular weight of 284.30 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-fluoro-2-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105248565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).