[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine

C14H16FN3 — CID 105211344

IUPAC[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2ccncc2F)cc1
InChIInChI=1S/C14H16FN3/c1-10-2-4-11(5-3-10)8-14(18-16)12-6-7-17-9-13(12)15/h2-7,9,14,18H,8,16H2,1H3
InChIKeyXIQNOFVQJMWTSV-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.28
Rot. Bonds4

About [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine

[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine (PubChem CID 105211344) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine
PubChem CID105211344
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2ccncc2F)cc1
InChIInChI=1S/C14H16FN3/c1-10-2-4-11(5-3-10)8-14(18-16)12-6-7-17-9-13(12)15/h2-7,9,14,18H,8,16H2,1H3
InChIKeyXIQNOFVQJMWTSV-UHFFFAOYSA-N
XLogP2.28
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.28
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 [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine (CID 105211344) is [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine is Cc1ccc(CC(NN)c2ccncc2F)cc1.
What is the InChIKey of [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine?
The InChIKey is XIQNOFVQJMWTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c1-10-2-4-11(5-3-10)8-14(18-16)12-6-7-17-9-13(12)15/h2-7,9,14,18H,8,16H2,1H3.
What are the key properties of [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine?
[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine has a molecular weight of 245.30 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105211344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).