[1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine

C14H16BrN3 — CID 105333652

IUPAC[1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine
SMILESCc1cc(Br)cc(C(Cc2cccnc2)NN)c1
InChIInChI=1S/C14H16BrN3/c1-10-5-12(8-13(15)6-10)14(18-16)7-11-3-2-4-17-9-11/h2-6,8-9,14,18H,7,16H2,1H3
InChIKeyGLTKQHCTXIPDPK-UHFFFAOYSA-N
MW306.21 g/mol
LogP2.90
Rot. Bonds4

About [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine

[1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine (PubChem CID 105333652) has the molecular formula C14H16BrN3 and a molecular weight of 306.21 g/mol. Its IUPAC name is [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine
PubChem CID105333652
Molecular FormulaC14H16BrN3
Molecular Weight306.21 g/mol
Exact Mass305.05
IUPAC Name[1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine
SMILESCc1cc(Br)cc(C(Cc2cccnc2)NN)c1
InChIInChI=1S/C14H16BrN3/c1-10-5-12(8-13(15)6-10)14(18-16)7-11-3-2-4-17-9-11/h2-6,8-9,14,18H,7,16H2,1H3
InChIKeyGLTKQHCTXIPDPK-UHFFFAOYSA-N
XLogP2.90
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.21
LogP ≤ 52.90
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

[1-(2-bromo-4-methylphenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333676
[1-(4-bromo-3-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333727
[2-(3-methylphenyl)-1-pyridin-3-ylethyl]hydrazine
CID 105196124
[1-(3,5-dibromophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 107978906
[1-(5-methylpyrimidin-2-yl)-2-pyridin-3-ylethyl]hydrazine
CID 105261546
[1-(3-bromo-5-methylphenyl)-2-(furan-3-yl)ethyl]hydrazine
CID 105331717
4-bromo-2-(1-hydrazinyl-2-pyridin-3-ylethyl)aniline
CID 105263506
1-(3-bromo-5-chlorophenyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 107946692
N-[1-(3-bromo-5-fluorophenyl)-2-pyridin-3-ylethyl]propan-1-amine
CID 104736468
[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine
CID 105253061
N-methyl-1-(5-methyl-3-pyridinyl)-2-pyridin-3-ylethanamine
CID 113297193
[1-(4-methylsulfonylphenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333643

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine?
The IUPAC name of [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine (CID 105333652) is [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine is Cc1cc(Br)cc(C(Cc2cccnc2)NN)c1.
What is the InChIKey of [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine?
The InChIKey is GLTKQHCTXIPDPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3/c1-10-5-12(8-13(15)6-10)14(18-16)7-11-3-2-4-17-9-11/h2-6,8-9,14,18H,7,16H2,1H3.
What are the key properties of [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine?
[1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine has a molecular weight of 306.21 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-5-methylphenyl)-2-pyridin-3-ylethyl]hydrazine is sourced from PubChem (CID 105333652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).