[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine

C14H13ClF3N3 — CID 105253088

IUPAC[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(Cc1ccc(C(F)(F)F)cc1)c1ccc(Cl)nc1
InChIInChI=1S/C14H13ClF3N3/c15-13-6-3-10(8-20-13)12(21-19)7-9-1-4-11(5-2-9)14(16,17)18/h1-6,8,12,21H,7,19H2
InChIKeyFTAWGZNITQZVCU-UHFFFAOYSA-N
MW315.73 g/mol
LogP3.50
Rot. Bonds4

About [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine

[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine (PubChem CID 105253088) has the molecular formula C14H13ClF3N3 and a molecular weight of 315.73 g/mol. Its IUPAC name is [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine.

Molecular Properties

Compound Name[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
PubChem CID105253088
Molecular FormulaC14H13ClF3N3
Molecular Weight315.73 g/mol
Exact Mass315.08
IUPAC Name[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(Cc1ccc(C(F)(F)F)cc1)c1ccc(Cl)nc1
InChIInChI=1S/C14H13ClF3N3/c15-13-6-3-10(8-20-13)12(21-19)7-9-1-4-11(5-2-9)14(16,17)18/h1-6,8,12,21H,7,19H2
InChIKeyFTAWGZNITQZVCU-UHFFFAOYSA-N
XLogP3.50
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.73
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(6-chloro-3-pyridinyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
CID 105252947
[1-(5-chloro-2-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105251515
[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine
CID 105253061
[1-(2-methyl-4-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 106756511
[1-(6-chloro-3-pyridinyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105253076
[1-(6-methyl-3-pyridinyl)-2-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105297239
[1-(3-methyltriazol-4-yl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105337598
[1-(6-chloro-3-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105253214
[1-(6-chloro-3-pyridinyl)-4-methylpentyl]hydrazine
CID 105252913
[1-(6-chloro-3-pyridinyl)-2-propan-2-yloxyethyl]hydrazine
CID 105253183
[1-(6-chloro-3-pyridinyl)-2-cyclopentylethyl]hydrazine
CID 105252962
[1-(5-methylthiophen-2-yl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105299672

Frequently Asked Questions

What is the IUPAC name of [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine?
The IUPAC name of [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine (CID 105253088) is [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine.
What is the SMILES notation for [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine?
The canonical SMILES for [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine is NNC(Cc1ccc(C(F)(F)F)cc1)c1ccc(Cl)nc1.
What is the InChIKey of [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine?
The InChIKey is FTAWGZNITQZVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClF3N3/c15-13-6-3-10(8-20-13)12(21-19)7-9-1-4-11(5-2-9)14(16,17)18/h1-6,8,12,21H,7,19H2.
What are the key properties of [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine?
[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine has a molecular weight of 315.73 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine is sourced from PubChem (CID 105253088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).