[(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine

C16H18BrN3 — CID 105267687

IUPAC[(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1ccc(Br)cn1)c1ccccc1C1CCC1
InChIInChI=1S/C16H18BrN3/c17-12-8-9-15(19-10-12)16(20-18)14-7-2-1-6-13(14)11-4-3-5-11/h1-2,6-11,16,20H,3-5,18H2
InChIKeyCNTJHMAAXWAUCF-UHFFFAOYSA-N
MW332.25 g/mol
LogP3.66
Rot. Bonds4

About [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine

[(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine (PubChem CID 105267687) has the molecular formula C16H18BrN3 and a molecular weight of 332.25 g/mol. Its IUPAC name is [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
PubChem CID105267687
Molecular FormulaC16H18BrN3
Molecular Weight332.25 g/mol
Exact Mass331.07
IUPAC Name[(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
SMILESNNC(c1ccc(Br)cn1)c1ccccc1C1CCC1
InChIInChI=1S/C16H18BrN3/c17-12-8-9-15(19-10-12)16(20-18)14-7-2-1-6-13(14)11-4-3-5-11/h1-2,6-11,16,20H,3-5,18H2
InChIKeyCNTJHMAAXWAUCF-UHFFFAOYSA-N
XLogP3.66
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.25
LogP ≤ 53.66
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

[(2-cyclobutylphenyl)-(2-methyl-1,3-thiazol-4-yl)methyl]hydrazine
CID 105341381
[(2-cyclobutylphenyl)-(2-iodophenyl)methyl]hydrazine
CID 105341369
[(2-chlorophenyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 105211009
1-(2-cyclobutylphenyl)ethylhydrazine
CID 105201232
[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 105341397
[(3-chloro-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 103445654
[(2-cyclobutylphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105341425
1-(4-bromophenyl)-1-(2-cyclobutylphenyl)-N-methylmethanamine
CID 114602530
[(2-cyclobutylphenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 105341367
[(2-cyclobutylphenyl)-(2,3-difluorophenyl)methyl]hydrazine
CID 105341400
1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 114602735
[(5-bromo-2-pyridinyl)-(4-bromothiophen-3-yl)methyl]hydrazine
CID 105267652

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine (CID 105267687) is [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine is NNC(c1ccc(Br)cn1)c1ccccc1C1CCC1.
What is the InChIKey of [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
The InChIKey is CNTJHMAAXWAUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrN3/c17-12-8-9-15(19-10-12)16(20-18)14-7-2-1-6-13(14)11-4-3-5-11/h1-2,6-11,16,20H,3-5,18H2.
What are the key properties of [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine?
[(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine has a molecular weight of 332.25 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine is sourced from PubChem (CID 105267687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).