[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine

C14H13Cl2FN2O — CID 103397720

IUPAC[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cc(Cl)cc(Cl)c2)c(F)c1
InChIInChI=1S/C14H13Cl2FN2O/c1-20-11-2-3-12(13(17)7-11)14(19-18)8-4-9(15)6-10(16)5-8/h2-7,14,19H,18H2,1H3
InChIKeyFUGQHRUBNOVXCO-UHFFFAOYSA-N
MW315.18 g/mol
LogP3.69
Rot. Bonds4

About [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine

[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine (PubChem CID 103397720) has the molecular formula C14H13Cl2FN2O and a molecular weight of 315.18 g/mol. Its IUPAC name is [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
PubChem CID103397720
Molecular FormulaC14H13Cl2FN2O
Molecular Weight315.18 g/mol
Exact Mass314.04
IUPAC Name[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cc(Cl)cc(Cl)c2)c(F)c1
InChIInChI=1S/C14H13Cl2FN2O/c1-20-11-2-3-12(13(17)7-11)14(19-18)8-4-9(15)6-10(16)5-8/h2-7,14,19H,18H2,1H3
InChIKeyFUGQHRUBNOVXCO-UHFFFAOYSA-N
XLogP3.69
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.18
LogP ≤ 53.69
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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Frequently Asked Questions

What is the IUPAC name of [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine (CID 103397720) is [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine is COc1ccc(C(NN)c2cc(Cl)cc(Cl)c2)c(F)c1.
What is the InChIKey of [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine?
The InChIKey is FUGQHRUBNOVXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2FN2O/c1-20-11-2-3-12(13(17)7-11)14(19-18)8-4-9(15)6-10(16)5-8/h2-7,14,19H,18H2,1H3.
What are the key properties of [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine?
[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine has a molecular weight of 315.18 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 103397720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).