[(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine

C14H16FN3 — CID 105257809

IUPAC[(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine
SMILESCc1ccc(C)c(C(NN)c2ncccc2F)c1
InChIInChI=1S/C14H16FN3/c1-9-5-6-10(2)11(8-9)13(18-16)14-12(15)4-3-7-17-14/h3-8,13,18H,16H2,1-2H3
InChIKeyVCTTTZOYABXGEI-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.39
Rot. Bonds3

About [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine

[(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine (PubChem CID 105257809) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine
PubChem CID105257809
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name[(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine
SMILESCc1ccc(C)c(C(NN)c2ncccc2F)c1
InChIInChI=1S/C14H16FN3/c1-9-5-6-10(2)11(8-9)13(18-16)14-12(15)4-3-7-17-14/h3-8,13,18H,16H2,1-2H3
InChIKeyVCTTTZOYABXGEI-UHFFFAOYSA-N
XLogP2.39
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine?
The IUPAC name of [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine (CID 105257809) is [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine is Cc1ccc(C)c(C(NN)c2ncccc2F)c1.
What is the InChIKey of [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine?
The InChIKey is VCTTTZOYABXGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c1-9-5-6-10(2)11(8-9)13(18-16)14-12(15)4-3-7-17-14/h3-8,13,18H,16H2,1-2H3.
What are the key properties of [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine?
[(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine has a molecular weight of 245.30 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dimethylphenyl)-(3-fluoro-2-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105257809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).