[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine

C16H18BrN3 — CID 105334602

IUPAC[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cn1)C1CC1c1ccccc1
InChIInChI=1S/C16H18BrN3/c17-12-6-7-13(19-10-12)8-16(20-18)15-9-14(15)11-4-2-1-3-5-11/h1-7,10,14-16,20H,8-9,18H2
InChIKeyXPYLGTXRUSQTKN-UHFFFAOYSA-N
MW332.25 g/mol
LogP3.02
Rot. Bonds5

About [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine

[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine (PubChem CID 105334602) has the molecular formula C16H18BrN3 and a molecular weight of 332.25 g/mol. Its IUPAC name is [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
PubChem CID105334602
Molecular FormulaC16H18BrN3
Molecular Weight332.25 g/mol
Exact Mass331.07
IUPAC Name[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cn1)C1CC1c1ccccc1
InChIInChI=1S/C16H18BrN3/c17-12-6-7-13(19-10-12)8-16(20-18)15-9-14(15)11-4-2-1-3-5-11/h1-7,10,14-16,20H,8-9,18H2
InChIKeyXPYLGTXRUSQTKN-UHFFFAOYSA-N
XLogP3.02
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.25
LogP ≤ 53.02
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-(5-bromo-3-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105334805
[2-(2-bromophenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105215061
[2-(4-bromo-2-chlorophenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105335247
[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105236080
[2-(5-bromo-2-pyridinyl)-1-(2,2-dimethylcyclopropyl)ethyl]hydrazine
CID 107005841
[2-(1-methylpyrazol-4-yl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105291195
[2-(5-bromo-2-pyridinyl)-1-(oxan-4-yl)ethyl]hydrazine
CID 105229627
[2-(5-bromo-2-pyridinyl)-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethyl]hydrazine
CID 105265764
[2-(5-bromo-2-pyridinyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]hydrazine
CID 105218838
1-(5-bromo-2-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 116517909
[2-(5-bromo-2-pyridinyl)-1-(1,4-dithian-2-yl)ethyl]hydrazine
CID 105249250
1-(2-phenylcyclopropyl)but-3-ynylhydrazine
CID 105281555

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine (CID 105334602) is [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine is NNC(Cc1ccc(Br)cn1)C1CC1c1ccccc1.
What is the InChIKey of [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine?
The InChIKey is XPYLGTXRUSQTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrN3/c17-12-6-7-13(19-10-12)8-16(20-18)15-9-14(15)11-4-2-1-3-5-11/h1-7,10,14-16,20H,8-9,18H2.
What are the key properties of [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine?
[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine has a molecular weight of 332.25 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine is sourced from PubChem (CID 105334602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).