[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine

C18H29BrN2 — CID 105283853

IUPAC[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine
SMILESCCCCC1CCC(C(Cc2ccccc2Br)NN)CC1
InChIInChI=1S/C18H29BrN2/c1-2-3-6-14-9-11-15(12-10-14)18(21-20)13-16-7-4-5-8-17(16)19/h4-5,7-8,14-15,18,21H,2-3,6,9-13,20H2,1H3
InChIKeyJNZNDDGAWDXLPF-UHFFFAOYSA-N
MW353.35 g/mol
LogP4.82
Rot. Bonds7

About [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine

[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine (PubChem CID 105283853) has the molecular formula C18H29BrN2 and a molecular weight of 353.35 g/mol. Its IUPAC name is [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine
PubChem CID105283853
Molecular FormulaC18H29BrN2
Molecular Weight353.35 g/mol
Exact Mass352.15
IUPAC Name[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine
SMILESCCCCC1CCC(C(Cc2ccccc2Br)NN)CC1
InChIInChI=1S/C18H29BrN2/c1-2-3-6-14-9-11-15(12-10-14)18(21-20)13-16-7-4-5-8-17(16)19/h4-5,7-8,14-15,18,21H,2-3,6,9-13,20H2,1H3
InChIKeyJNZNDDGAWDXLPF-UHFFFAOYSA-N
XLogP4.82
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.35
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine (CID 105283853) is [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine is CCCCC1CCC(C(Cc2ccccc2Br)NN)CC1.
What is the InChIKey of [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine?
The InChIKey is JNZNDDGAWDXLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29BrN2/c1-2-3-6-14-9-11-15(12-10-14)18(21-20)13-16-7-4-5-8-17(16)19/h4-5,7-8,14-15,18,21H,2-3,6,9-13,20H2,1H3.
What are the key properties of [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine?
[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine has a molecular weight of 353.35 g/mol, XLogP of 4.82, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine is sourced from PubChem (CID 105283853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).