[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine

C13H13ClFN3O — CID 114275504

IUPAC[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
SMILESCOc1ncccc1C(NN)c1c(F)cccc1Cl
InChIInChI=1S/C13H13ClFN3O/c1-19-13-8(4-3-7-17-13)12(18-16)11-9(14)5-2-6-10(11)15/h2-7,12,18H,16H2,1H3
InChIKeyQKBFUCQHMIUCEG-UHFFFAOYSA-N
MW281.72 g/mol
LogP2.44
Rot. Bonds4

About [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine

[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 114275504) has the molecular formula C13H13ClFN3O and a molecular weight of 281.72 g/mol. Its IUPAC name is [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
PubChem CID114275504
Molecular FormulaC13H13ClFN3O
Molecular Weight281.72 g/mol
Exact Mass281.07
IUPAC Name[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
SMILESCOc1ncccc1C(NN)c1c(F)cccc1Cl
InChIInChI=1S/C13H13ClFN3O/c1-19-13-8(4-3-7-17-13)12(18-16)11-9(14)5-2-6-10(11)15/h2-7,12,18H,16H2,1H3
InChIKeyQKBFUCQHMIUCEG-UHFFFAOYSA-N
XLogP2.44
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.72
LogP ≤ 52.44
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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Related Compounds

[(3-bromo-2,6-difluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 106945571
[(2-chloro-6-fluorophenyl)-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105329251
[(3-chlorothiophen-2-yl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 107362326
[(2-methoxy-3-pyridinyl)-(4-methylphenyl)methyl]hydrazine
CID 105285352
[2-(2,6-difluorophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105342854
[(2-chlorophenyl)-(2,6-difluorophenyl)methyl]hydrazine
CID 105210999
[(2-chloro-6-fluorophenyl)-(4-methoxy-2,5-dimethylphenyl)methyl]hydrazine
CID 105332922
[furan-2-yl-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 105306021
[(2-methoxy-3-pyridinyl)-(3-methylphenyl)methyl]hydrazine
CID 105284864
[(3,5-dimethylphenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 105286727
[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105308170
[(2-chloro-6-fluorophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105301084

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine (CID 114275504) is [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine is COc1ncccc1C(NN)c1c(F)cccc1Cl.
What is the InChIKey of [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is QKBFUCQHMIUCEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClFN3O/c1-19-13-8(4-3-7-17-13)12(18-16)11-9(14)5-2-6-10(11)15/h2-7,12,18H,16H2,1H3.
What are the key properties of [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine?
[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 281.72 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 114275504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).