[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine

C14H15BrFN3O — CID 105327156

IUPAC[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
SMILESCOc1cnccc1C(Cc1cccc(F)c1Br)NN
InChIInChI=1S/C14H15BrFN3O/c1-20-13-8-18-6-5-10(13)12(19-17)7-9-3-2-4-11(16)14(9)15/h2-6,8,12,19H,7,17H2,1H3
InChIKeyPNJYDAWNXWOIDS-UHFFFAOYSA-N
MW340.20 g/mol
LogP2.74
Rot. Bonds5

About [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine

[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine (PubChem CID 105327156) has the molecular formula C14H15BrFN3O and a molecular weight of 340.20 g/mol. Its IUPAC name is [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
PubChem CID105327156
Molecular FormulaC14H15BrFN3O
Molecular Weight340.20 g/mol
Exact Mass339.04
IUPAC Name[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
SMILESCOc1cnccc1C(Cc1cccc(F)c1Br)NN
InChIInChI=1S/C14H15BrFN3O/c1-20-13-8-18-6-5-10(13)12(19-17)7-9-3-2-4-11(16)14(9)15/h2-6,8,12,19H,7,17H2,1H3
InChIKeyPNJYDAWNXWOIDS-UHFFFAOYSA-N
XLogP2.74
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.20
LogP ≤ 52.74
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

[2-(2-bromo-3-fluorophenyl)-1-(5-chloro-2-methoxyphenyl)ethyl]hydrazine
CID 105327100
[2-(2-bromo-3-fluorophenyl)-1-(4-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105327080
[2-(2-bromo-3-fluorophenyl)-1-(2-ethoxyphenyl)ethyl]hydrazine
CID 105260715
[2-(3,4-difluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
CID 105330426
[2-(3-bromo-5-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
CID 105324870
2-(2-bromophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylethanamine
CID 105065184
[1-(3-methoxy-4-pyridinyl)-2-pyridin-2-ylethyl]hydrazine
CID 105315394
[2-(2-bromo-3-fluorophenyl)-1-(2,3-dimethylphenyl)ethyl]hydrazine
CID 105327015
[2-(2-chloro-3-fluorophenyl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261749
3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine
CID 105252589
[2-(2-bromo-3-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine
CID 105260420
[2-(2-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105206960

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine (CID 105327156) is [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine is COc1cnccc1C(Cc1cccc(F)c1Br)NN.
What is the InChIKey of [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
The InChIKey is PNJYDAWNXWOIDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrFN3O/c1-20-13-8-18-6-5-10(13)12(19-17)7-9-3-2-4-11(16)14(9)15/h2-6,8,12,19H,7,17H2,1H3.
What are the key properties of [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine?
[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine has a molecular weight of 340.20 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105327156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).