[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine

C13H13ClFN3O — CID 105248290

IUPAC[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
SMILESCOc1cc(C(NN)c2ccc(F)cn2)ccc1Cl
InChIInChI=1S/C13H13ClFN3O/c1-19-12-6-8(2-4-10(12)14)13(18-16)11-5-3-9(15)7-17-11/h2-7,13,18H,16H2,1H3
InChIKeyOYJLXXNFJNKLSY-UHFFFAOYSA-N
MW281.72 g/mol
LogP2.44
Rot. Bonds4

About [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine

[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine (PubChem CID 105248290) has the molecular formula C13H13ClFN3O and a molecular weight of 281.72 g/mol. Its IUPAC name is [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
PubChem CID105248290
Molecular FormulaC13H13ClFN3O
Molecular Weight281.72 g/mol
Exact Mass281.07
IUPAC Name[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
SMILESCOc1cc(C(NN)c2ccc(F)cn2)ccc1Cl
InChIInChI=1S/C13H13ClFN3O/c1-19-12-6-8(2-4-10(12)14)13(18-16)11-5-3-9(15)7-17-11/h2-7,13,18H,16H2,1H3
InChIKeyOYJLXXNFJNKLSY-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-chloro-4-methylphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
CID 107562414
[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine
CID 103375610
[(2-bromo-5-fluorophenyl)-(4-chloro-3-methoxyphenyl)methyl]hydrazine
CID 105320841
[(3,4-difluorophenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
CID 105248376
[(4-chloro-3-methoxyphenyl)-phenylmethyl]hydrazine
CID 105199196
[(4-chloro-3-methoxyphenyl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105204007
[(5-chloro-2-pyridinyl)-(4-fluorophenyl)methyl]hydrazine
CID 105251495
[(4-chloro-3-methoxyphenyl)-(3-chloro-4-pyridinyl)methyl]hydrazine
CID 105320814
[(4-chloro-3-methoxyphenyl)-(6-methyl-2-pyridinyl)methyl]hydrazine
CID 105219005
[(4-chloro-3-methoxyphenyl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258314
[(4-chloro-3-methoxyphenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105320725
[(5-fluoro-2-pyridinyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105248508

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine (CID 105248290) is [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine is COc1cc(C(NN)c2ccc(F)cn2)ccc1Cl.
What is the InChIKey of [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine?
The InChIKey is OYJLXXNFJNKLSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClFN3O/c1-19-12-6-8(2-4-10(12)14)13(18-16)11-5-3-9(15)7-17-11/h2-7,13,18H,16H2,1H3.
What are the key properties of [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine?
[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-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 [(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105248290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).