[(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine

C17H21BrN2 — CID 105340454

IUPAC[(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine
SMILESCCCc1cccc(C(NN)c2ccc(Br)cc2C)c1
InChIInChI=1S/C17H21BrN2/c1-3-5-13-6-4-7-14(11-13)17(20-19)16-9-8-15(18)10-12(16)2/h4,6-11,17,20H,3,5,19H2,1-2H3
InChIKeyLMGYMZNIDDRAHR-UHFFFAOYSA-N
MW333.27 g/mol
LogP4.26
Rot. Bonds5

About [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine

[(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine (PubChem CID 105340454) has the molecular formula C17H21BrN2 and a molecular weight of 333.27 g/mol. Its IUPAC name is [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine
PubChem CID105340454
Molecular FormulaC17H21BrN2
Molecular Weight333.27 g/mol
Exact Mass332.09
IUPAC Name[(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine
SMILESCCCc1cccc(C(NN)c2ccc(Br)cc2C)c1
InChIInChI=1S/C17H21BrN2/c1-3-5-13-6-4-7-14(11-13)17(20-19)16-9-8-15(18)10-12(16)2/h4,6-11,17,20H,3,5,19H2,1-2H3
InChIKeyLMGYMZNIDDRAHR-UHFFFAOYSA-N
XLogP4.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.27
LogP ≤ 54.26
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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Related Compounds

[(3,4-dimethylphenyl)-(3-propylphenyl)methyl]hydrazine
CID 105340471
[(4-methyl-3-pyridinyl)-(3-propylphenyl)methyl]hydrazine
CID 105279913
[(2,5-dibromophenyl)-(3-ethylphenyl)methyl]hydrazine
CID 105326320
[(3-bromophenyl)-(4-propylphenyl)methyl]hydrazine
CID 105197895
1-(4-bromo-2-methylphenyl)-N-methyl-1-(4-propylphenyl)methanamine
CID 43629813
[(5-bromo-2-fluorophenyl)-(3-ethylphenyl)methyl]hydrazine
CID 105280590
[(2,4-dibromophenyl)-[3-(2-methylpropyl)phenyl]methyl]hydrazine
CID 107948551
1-(4-bromo-3-methylphenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 105050441
[(3-ethoxyphenyl)-(3-propylphenyl)methyl]hydrazine
CID 105192042
[(3-methoxy-4-methylphenyl)-(3-propylphenyl)methyl]hydrazine
CID 105340457
(4-bromo-2-chlorophenyl)-(3-propylphenyl)methanamine
CID 105050353
(4-bromo-2-fluorophenyl)-(3-propylphenyl)methanamine
CID 114906021

Frequently Asked Questions

What is the IUPAC name of [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine?
The IUPAC name of [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine (CID 105340454) is [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine is CCCc1cccc(C(NN)c2ccc(Br)cc2C)c1.
What is the InChIKey of [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine?
The InChIKey is LMGYMZNIDDRAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21BrN2/c1-3-5-13-6-4-7-14(11-13)17(20-19)16-9-8-15(18)10-12(16)2/h4,6-11,17,20H,3,5,19H2,1-2H3.
What are the key properties of [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine?
[(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine has a molecular weight of 333.27 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-2-methylphenyl)-(3-propylphenyl)methyl]hydrazine is sourced from PubChem (CID 105340454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).