[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine

C13H19BrN2O — CID 105315194

IUPAC[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine
SMILESCOc1ccc(C(CCC2CC2)NN)cc1Br
InChIInChI=1S/C13H19BrN2O/c1-17-13-7-5-10(8-11(13)14)12(16-15)6-4-9-2-3-9/h5,7-9,12,16H,2-4,6,15H2,1H3
InChIKeyUEWUOOSCDYRMIY-UHFFFAOYSA-N
MW299.21 g/mol
LogP3.15
Rot. Bonds6

About [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine

[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine (PubChem CID 105315194) has the molecular formula C13H19BrN2O and a molecular weight of 299.21 g/mol. Its IUPAC name is [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine
PubChem CID105315194
Molecular FormulaC13H19BrN2O
Molecular Weight299.21 g/mol
Exact Mass298.07
IUPAC Name[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine
SMILESCOc1ccc(C(CCC2CC2)NN)cc1Br
InChIInChI=1S/C13H19BrN2O/c1-17-13-7-5-10(8-11(13)14)12(16-15)6-4-9-2-3-9/h5,7-9,12,16H,2-4,6,15H2,1H3
InChIKeyUEWUOOSCDYRMIY-UHFFFAOYSA-N
XLogP3.15
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.21
LogP ≤ 53.15
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'}

Analyze [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-cyclopropyl-1-(4-fluoro-3-methoxyphenyl)propyl]hydrazine
CID 105315091
[1-(3-bromo-4-methoxyphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298912
[1-(4-bromo-3-chlorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105315140
[1-(3-bromo-4-methoxyphenyl)-3-methylsulfonylpropyl]hydrazine
CID 114985195
[1-(2-bromo-5-methoxyphenyl)-3-cyclopropylpropyl]hydrazine
CID 105315167
[1-(3-bromo-4-methoxyphenyl)-3-methylpentyl]hydrazine
CID 105298627
[1-(3-bromo-4-methoxyphenyl)-3-thiophen-2-ylpropyl]hydrazine
CID 105308969
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329211
[1-(3-bromo-4-methoxyphenyl)-2-(2-bromophenyl)ethyl]hydrazine
CID 105283965
2-(3-bromo-4-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 54916019
[1-(3-chloro-4-methylphenyl)-3-cyclopropylpropyl]hydrazine
CID 105315126
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dichlorophenyl)ethyl]hydrazine
CID 105293177

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine?
The IUPAC name of [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine (CID 105315194) is [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine?
The canonical SMILES for [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine is COc1ccc(C(CCC2CC2)NN)cc1Br.
What is the InChIKey of [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine?
The InChIKey is UEWUOOSCDYRMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BrN2O/c1-17-13-7-5-10(8-11(13)14)12(16-15)6-4-9-2-3-9/h5,7-9,12,16H,2-4,6,15H2,1H3.
What are the key properties of [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine?
[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine has a molecular weight of 299.21 g/mol, XLogP of 3.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine is sourced from PubChem (CID 105315194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).