[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine

C14H16BrN3O2 — CID 105251245

IUPAC[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)c2cncc(Br)c2)c1
InChIInChI=1S/C14H16BrN3O2/c1-19-12-4-9(5-13(6-12)20-2)14(18-16)10-3-11(15)8-17-7-10/h3-8,14,18H,16H2,1-2H3
InChIKeyBWEOAIKFICHKOE-UHFFFAOYSA-N
MW338.21 g/mol
LogP2.41
Rot. Bonds5

About [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine

[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine (PubChem CID 105251245) has the molecular formula C14H16BrN3O2 and a molecular weight of 338.21 g/mol. Its IUPAC name is [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine
PubChem CID105251245
Molecular FormulaC14H16BrN3O2
Molecular Weight338.21 g/mol
Exact Mass337.04
IUPAC Name[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)c2cncc(Br)c2)c1
InChIInChI=1S/C14H16BrN3O2/c1-19-12-4-9(5-13(6-12)20-2)14(18-16)10-3-11(15)8-17-7-10/h3-8,14,18H,16H2,1-2H3
InChIKeyBWEOAIKFICHKOE-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

[(3,5-dimethoxyphenyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105329847
[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105251101
[(5-bromo-3-pyridinyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105251286
[(5-methoxy-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105329816
[(4-bromothiophen-2-yl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105222663
[(5-bromo-3-pyridinyl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105251229
[(3-bromo-4-methoxyphenyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105329820
[(5-bromo-3-pyridinyl)-naphthalen-2-ylmethyl]hydrazine
CID 105251096
[(2-bromophenyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105208806
1-(5-bromo-3-pyridinyl)-1-(4-methoxy-2-methylphenyl)-N-methylmethanamine
CID 43482761
[(3,5-dibromophenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 107978916
[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 107948448

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine (CID 105251245) is [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine is COc1cc(OC)cc(C(NN)c2cncc(Br)c2)c1.
What is the InChIKey of [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
The InChIKey is BWEOAIKFICHKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3O2/c1-19-12-4-9(5-13(6-12)20-2)14(18-16)10-3-11(15)8-17-7-10/h3-8,14,18H,16H2,1-2H3.
What are the key properties of [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]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 [(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105251245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).