[(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine

C9H10FN5 — CID 105230496

IUPAC[(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
SMILESNNC(c1cccc(F)c1)c1ncn[nH]1
InChIInChI=1S/C9H10FN5/c10-7-3-1-2-6(4-7)8(14-11)9-12-5-13-15-9/h1-5,8,14H,11H2,(H,12,13,15)
InChIKeyLHKHIOGVUSWICA-UHFFFAOYSA-N
MW207.21 g/mol
LogP0.50
Rot. Bonds3

About [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine

[(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine (PubChem CID 105230496) has the molecular formula C9H10FN5 and a molecular weight of 207.21 g/mol. Its IUPAC name is [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
PubChem CID105230496
Molecular FormulaC9H10FN5
Molecular Weight207.21 g/mol
Exact Mass207.09
IUPAC Name[(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
SMILESNNC(c1cccc(F)c1)c1ncn[nH]1
InChIInChI=1S/C9H10FN5/c10-7-3-1-2-6(4-7)8(14-11)9-12-5-13-15-9/h1-5,8,14H,11H2,(H,12,13,15)
InChIKeyLHKHIOGVUSWICA-UHFFFAOYSA-N
XLogP0.50
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 50.50
H-Bond Donors ≤ 53
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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Related Compounds

[(3-fluoro-5-methylphenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230645
[(4-phenylphenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230368
[(7-fluoro-1-benzofuran-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230636
[(3-fluorophenyl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105193053
[(5-methylthiophen-3-yl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230618
[(2,4-difluorophenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105193044
[(2-methylphenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230315
[(3,4-dimethylphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105193094
[(2-ethoxyphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105192906
[quinolin-8-yl(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230361
N-[(3-methylphenyl)-(1H-1,2,4-triazol-5-yl)methyl]propan-1-amine
CID 65360196
[1H-1,2,4-triazol-5-yl-[2-(trifluoromethoxy)phenyl]methyl]hydrazine
CID 105230561

Frequently Asked Questions

What is the IUPAC name of [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine?
The IUPAC name of [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine (CID 105230496) is [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine is NNC(c1cccc(F)c1)c1ncn[nH]1.
What is the InChIKey of [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine?
The InChIKey is LHKHIOGVUSWICA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN5/c10-7-3-1-2-6(4-7)8(14-11)9-12-5-13-15-9/h1-5,8,14H,11H2,(H,12,13,15).
What are the key properties of [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine?
[(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine has a molecular weight of 207.21 g/mol, XLogP of 0.50, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluorophenyl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105230496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).