[1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine

C15H19BrN4O — CID 105251270

IUPAC[1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine
SMILESCOc1c(C)cnc(CC(NN)c2cncc(Br)c2)c1C
InChIInChI=1S/C15H19BrN4O/c1-9-6-19-13(10(2)15(9)21-3)5-14(20-17)11-4-12(16)8-18-7-11/h4,6-8,14,20H,5,17H2,1-3H3
InChIKeyNMLQIWKNSSKMDV-UHFFFAOYSA-N
MW351.25 g/mol
LogP2.61
Rot. Bonds5

About [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine

[1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine (PubChem CID 105251270) has the molecular formula C15H19BrN4O and a molecular weight of 351.25 g/mol. Its IUPAC name is [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine
PubChem CID105251270
Molecular FormulaC15H19BrN4O
Molecular Weight351.25 g/mol
Exact Mass350.07
IUPAC Name[1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine
SMILESCOc1c(C)cnc(CC(NN)c2cncc(Br)c2)c1C
InChIInChI=1S/C15H19BrN4O/c1-9-6-19-13(10(2)15(9)21-3)5-14(20-17)11-4-12(16)8-18-7-11/h4,6-8,14,20H,5,17H2,1-3H3
InChIKeyNMLQIWKNSSKMDV-UHFFFAOYSA-N
XLogP2.61
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.25
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105279925
[1-(2-bromofuran-3-yl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine
CID 106859817
[2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(5-methylpyrazin-2-yl)ethyl]hydrazine
CID 105297174
[2-(5-bromo-2-methoxyphenyl)-1-(5-bromo-3-pyridinyl)ethyl]hydrazine
CID 105251172
[2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(1-methylimidazol-4-yl)ethyl]hydrazine
CID 114023428
2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-pyrimidin-5-ylethanamine
CID 102923368
2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-methyl-1-pyridin-4-ylethanamine
CID 62601677
[2-(2-bromo-5-methoxyphenyl)-1-(5-bromo-3-pyridinyl)ethyl]hydrazine
CID 105251145
1-(4,5-dibromothiophen-2-yl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-methylethanamine
CID 115844021
1-(5-bromo-2-fluorophenyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 114894511
1-(5-bromofuran-2-yl)-N-ethyl-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 115844039
1-(5-bromo-3-pyridinyl)butylhydrazine
CID 105251041

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine (CID 105251270) is [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine is COc1c(C)cnc(CC(NN)c2cncc(Br)c2)c1C.
What is the InChIKey of [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine?
The InChIKey is NMLQIWKNSSKMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrN4O/c1-9-6-19-13(10(2)15(9)21-3)5-14(20-17)11-4-12(16)8-18-7-11/h4,6-8,14,20H,5,17H2,1-3H3.
What are the key properties of [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine?
[1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine has a molecular weight of 351.25 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-3-pyridinyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105251270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).