[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine

C14H16BrN3O — CID 105268203

IUPAC[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ncccc2Br)c1
InChIInChI=1S/C14H16BrN3O/c1-19-11-5-2-4-10(8-11)9-13(18-16)14-12(15)6-3-7-17-14/h2-8,13,18H,9,16H2,1H3
InChIKeyWSPCIVICBKISGA-UHFFFAOYSA-N
MW322.21 g/mol
LogP2.60
Rot. Bonds5

About [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine

[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine (PubChem CID 105268203) has the molecular formula C14H16BrN3O and a molecular weight of 322.21 g/mol. Its IUPAC name is [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
PubChem CID105268203
Molecular FormulaC14H16BrN3O
Molecular Weight322.21 g/mol
Exact Mass321.05
IUPAC Name[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ncccc2Br)c1
InChIInChI=1S/C14H16BrN3O/c1-19-11-5-2-4-10(8-11)9-13(18-16)14-12(15)6-3-7-17-14/h2-8,13,18H,9,16H2,1H3
InChIKeyWSPCIVICBKISGA-UHFFFAOYSA-N
XLogP2.60
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.21
LogP ≤ 52.60
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

[1-(3-ethyl-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105263917
[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105268027
[1-(3-bromo-2-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105268064
[1-(3-bromo-2-pyridinyl)-2-(4-ethylphenyl)ethyl]hydrazine
CID 105267953
[1-(3-bromo-4-fluorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105264219
[1-(4-bromo-3-methylphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295298
[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295409
[2-(3-methoxyphenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105190967
[1-(3-ethoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105192057
[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
CID 105205136
[2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105284546
[2-(3-methoxyphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
CID 105295350

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine (CID 105268203) is [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine is COc1cccc(CC(NN)c2ncccc2Br)c1.
What is the InChIKey of [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine?
The InChIKey is WSPCIVICBKISGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3O/c1-19-11-5-2-4-10(8-11)9-13(18-16)14-12(15)6-3-7-17-14/h2-8,13,18H,9,16H2,1H3.
What are the key properties of [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine?
[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine has a molecular weight of 322.21 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105268203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).