[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine

C13H13BrClN3 — CID 107948433

IUPAC[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1cncc(C(NN)c2cc(Cl)cc(Br)c2)c1
InChIInChI=1S/C13H13BrClN3/c1-8-2-10(7-17-6-8)13(18-16)9-3-11(14)5-12(15)4-9/h2-7,13,18H,16H2,1H3
InChIKeyONMORVCWZSQVPI-UHFFFAOYSA-N
MW326.63 g/mol
LogP3.36
Rot. Bonds3

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

[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine (PubChem CID 107948433) has the molecular formula C13H13BrClN3 and a molecular weight of 326.63 g/mol. Its IUPAC name is [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
PubChem CID107948433
Molecular FormulaC13H13BrClN3
Molecular Weight326.63 g/mol
Exact Mass325.00
IUPAC Name[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1cncc(C(NN)c2cc(Cl)cc(Br)c2)c1
InChIInChI=1S/C13H13BrClN3/c1-8-2-10(7-17-6-8)13(18-16)9-3-11(14)5-12(15)4-9/h2-7,13,18H,16H2,1H3
InChIKeyONMORVCWZSQVPI-UHFFFAOYSA-N
XLogP3.36
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.63
LogP ≤ 53.36
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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Related Compounds

[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105251101
[(3-bromo-5-chlorophenyl)-(3-methylphenyl)methyl]hydrazine
CID 107948017
[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 107948448
[(3,4-dichlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105257086
1-(3-chloro-5-methylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)methanamine
CID 105023291
[(3-bromo-5-chlorophenyl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 107948189
1-(3-bromo-5-chlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 107945193
[(3,5-dibromophenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 107978916
[(5-methoxy-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105329816
[(5-methyl-3-pyridinyl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305579
(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 105023142
[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine
CID 105251245

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine (CID 107948433) is [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine is Cc1cncc(C(NN)c2cc(Cl)cc(Br)c2)c1.
What is the InChIKey of [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The InChIKey is ONMORVCWZSQVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrClN3/c1-8-2-10(7-17-6-8)13(18-16)9-3-11(14)5-12(15)4-9/h2-7,13,18H,16H2,1H3.
What are the key properties of [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine has a molecular weight of 326.63 g/mol, XLogP of 3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 107948433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).