[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine

C15H22BrN5 — CID 106756613

IUPAC[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine
SMILESCCc1nn(CC)c(CC(NN)c2ccnc(C)c2)c1Br
InChIInChI=1S/C15H22BrN5/c1-4-12-15(16)14(21(5-2)20-12)9-13(19-17)11-6-7-18-10(3)8-11/h6-8,13,19H,4-5,9,17H2,1-3H3
InChIKeyRIZVHAVWFQPQKS-UHFFFAOYSA-N
MW352.28 g/mol
LogP2.68
Rot. Bonds6

About [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine

[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine (PubChem CID 106756613) has the molecular formula C15H22BrN5 and a molecular weight of 352.28 g/mol. Its IUPAC name is [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine
PubChem CID106756613
Molecular FormulaC15H22BrN5
Molecular Weight352.28 g/mol
Exact Mass351.11
IUPAC Name[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine
SMILESCCc1nn(CC)c(CC(NN)c2ccnc(C)c2)c1Br
InChIInChI=1S/C15H22BrN5/c1-4-12-15(16)14(21(5-2)20-12)9-13(19-17)11-6-7-18-10(3)8-11/h6-8,13,19H,4-5,9,17H2,1-3H3
InChIKeyRIZVHAVWFQPQKS-UHFFFAOYSA-N
XLogP2.68
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.28
LogP ≤ 52.68
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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Frequently Asked Questions

What is the IUPAC name of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine (CID 106756613) is [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine is CCc1nn(CC)c(CC(NN)c2ccnc(C)c2)c1Br.
What is the InChIKey of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine?
The InChIKey is RIZVHAVWFQPQKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22BrN5/c1-4-12-15(16)14(21(5-2)20-12)9-13(19-17)11-6-7-18-10(3)8-11/h6-8,13,19H,4-5,9,17H2,1-3H3.
What are the key properties of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine?
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine has a molecular weight of 352.28 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 106756613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).