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

C14H13F4N3 — CID 105235142

IUPAC[1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(Cc1cccc(C(F)(F)F)c1)c1ccncc1F
InChIInChI=1S/C14H13F4N3/c15-12-8-20-5-4-11(12)13(21-19)7-9-2-1-3-10(6-9)14(16,17)18/h1-6,8,13,21H,7,19H2
InChIKeyRXBOWYSQKGPTMU-UHFFFAOYSA-N
MW299.27 g/mol
LogP2.99
Rot. Bonds4

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

[1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine (PubChem CID 105235142) has the molecular formula C14H13F4N3 and a molecular weight of 299.27 g/mol. Its IUPAC name is [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
PubChem CID105235142
Molecular FormulaC14H13F4N3
Molecular Weight299.27 g/mol
Exact Mass299.10
IUPAC Name[1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(Cc1cccc(C(F)(F)F)c1)c1ccncc1F
InChIInChI=1S/C14H13F4N3/c15-12-8-20-5-4-11(12)13(21-19)7-9-2-1-3-10(6-9)14(16,17)18/h1-6,8,13,21H,7,19H2
InChIKeyRXBOWYSQKGPTMU-UHFFFAOYSA-N
XLogP2.99
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.27
LogP ≤ 52.99
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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Related Compounds

3-[1-hydrazinyl-2-[3-(trifluoromethyl)phenyl]ethyl]pyridin-2-amine
CID 105235141
N-methyl-1-(4-methyl-3-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 66273581
[1-(3-fluoro-4-pyridinyl)-2-(4-methylphenyl)ethyl]hydrazine
CID 105211344
[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
CID 105206013
[1-(3-bromo-2-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105268064
[1-(3-bromothiophen-2-yl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105235170
[1-(3-chlorothiophen-2-yl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105293218
N-ethyl-1-pyridin-4-yl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 62602438
[1-(3-fluoro-4-pyridinyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105335444
[2-(2-bromo-4-fluorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105258571
[2-(3-chloro-4-fluorophenyl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 103044062
[1-[3-fluoro-4-(trifluoromethyl)phenyl]-2-pyridin-3-ylethyl]hydrazine
CID 107292272

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
The IUPAC name of [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine (CID 105235142) is [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine is NNC(Cc1cccc(C(F)(F)F)c1)c1ccncc1F.
What is the InChIKey of [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
The InChIKey is RXBOWYSQKGPTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F4N3/c15-12-8-20-5-4-11(12)13(21-19)7-9-2-1-3-10(6-9)14(16,17)18/h1-6,8,13,21H,7,19H2.
What are the key properties of [1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine?
[1-(3-fluoro-4-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine has a molecular weight of 299.27 g/mol, XLogP of 2.99, 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-[3-(trifluoromethyl)phenyl]ethyl]hydrazine is sourced from PubChem (CID 105235142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).