[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine

C14H15F2N3O — CID 105330426

IUPAC[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
SMILESCOc1cnccc1C(Cc1ccc(F)c(F)c1)NN
InChIInChI=1S/C14H15F2N3O/c1-20-14-8-18-5-4-10(14)13(19-17)7-9-2-3-11(15)12(16)6-9/h2-6,8,13,19H,7,17H2,1H3
InChIKeySPTUSYNPUAYZNQ-UHFFFAOYSA-N
MW279.29 g/mol
LogP2.12
Rot. Bonds5

About [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine

[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine (PubChem CID 105330426) has the molecular formula C14H15F2N3O and a molecular weight of 279.29 g/mol. Its IUPAC name is [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
PubChem CID105330426
Molecular FormulaC14H15F2N3O
Molecular Weight279.29 g/mol
Exact Mass279.12
IUPAC Name[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
SMILESCOc1cnccc1C(Cc1ccc(F)c(F)c1)NN
InChIInChI=1S/C14H15F2N3O/c1-20-14-8-18-5-4-10(14)13(19-17)7-9-2-3-11(15)12(16)6-9/h2-6,8,13,19H,7,17H2,1H3
InChIKeySPTUSYNPUAYZNQ-UHFFFAOYSA-N
XLogP2.12
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 52.12
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine (CID 105330426) is [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine is COc1cnccc1C(Cc1ccc(F)c(F)c1)NN.
What is the InChIKey of [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
The InChIKey is SPTUSYNPUAYZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3O/c1-20-14-8-18-5-4-10(14)13(19-17)7-9-2-3-11(15)12(16)6-9/h2-6,8,13,19H,7,17H2,1H3.
What are the key properties of [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine has a molecular weight of 279.29 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105330426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).