[(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine

C14H16BrN3O2 — CID 103524568

IUPAC[(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccncc2)c(OC)c1Br
InChIInChI=1S/C14H16BrN3O2/c1-19-11-4-3-10(14(20-2)12(11)15)13(18-16)9-5-7-17-8-6-9/h3-8,13,18H,16H2,1-2H3
InChIKeyVPHNFIAGOJUNEZ-UHFFFAOYSA-N
MW338.21 g/mol
LogP2.41
Rot. Bonds5

About [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine

[(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine (PubChem CID 103524568) has the molecular formula C14H16BrN3O2 and a molecular weight of 338.21 g/mol. Its IUPAC name is [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine
PubChem CID103524568
Molecular FormulaC14H16BrN3O2
Molecular Weight338.21 g/mol
Exact Mass337.04
IUPAC Name[(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccncc2)c(OC)c1Br
InChIInChI=1S/C14H16BrN3O2/c1-19-11-4-3-10(14(20-2)12(11)15)13(18-16)9-5-7-17-8-6-9/h3-8,13,18H,16H2,1-2H3
InChIKeyVPHNFIAGOJUNEZ-UHFFFAOYSA-N
XLogP2.41
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.21
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-2,4-dimethoxyphenyl)-(4-iodophenyl)methyl]hydrazine
CID 103524744
[(2-methoxyphenyl)-pyridin-4-ylmethyl]hydrazine
CID 105196350
4-[(3-bromo-2,4-dimethoxyphenyl)-hydrazinylmethyl]-1H-pyrazol-5-amine
CID 103524628
4-[(3-bromo-2,4-dimethoxyphenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
CID 103524627
[(3-bromo-2,4-dimethoxyphenyl)-(1,5-dimethylpyrazol-4-yl)methyl]hydrazine
CID 103524736
1-(3-bromo-2,4-dimethoxyphenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 103524439
[(3-bromo-2,4-dimethoxyphenyl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine
CID 103524729
[pyridin-4-yl-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105196567
[(4-chlorophenyl)-(3-methoxy-4-pyridinyl)methyl]hydrazine
CID 105281225
[(3-bromo-2,4-dimethoxyphenyl)-cyclohexylmethyl]hydrazine
CID 103524580
N-[(3-bromo-2,4-dimethoxyphenyl)-pyrazin-2-ylmethyl]ethanamine
CID 103523310
(3-bromo-2,4-dimethoxyphenyl)-(3-chloro-2-pyridinyl)methanamine
CID 103523606

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine?
The IUPAC name of [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine (CID 103524568) is [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine.
What is the SMILES notation for [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine?
The canonical SMILES for [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine is COc1ccc(C(NN)c2ccncc2)c(OC)c1Br.
What is the InChIKey of [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine?
The InChIKey is VPHNFIAGOJUNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3O2/c1-19-11-4-3-10(14(20-2)12(11)15)13(18-16)9-5-7-17-8-6-9/h3-8,13,18H,16H2,1-2H3.
What are the key properties of [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine?
[(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine has a molecular weight of 338.21 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-2,4-dimethoxyphenyl)-pyridin-4-ylmethyl]hydrazine is sourced from PubChem (CID 103524568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).