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

C14H19BrFN5 — CID 105258683

IUPAC[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
SMILESCCc1nn(CC)c(CC(NN)c2ccncc2F)c1Br
InChIInChI=1S/C14H19BrFN5/c1-3-11-14(15)13(21(4-2)20-11)7-12(19-17)9-5-6-18-8-10(9)16/h5-6,8,12,19H,3-4,7,17H2,1-2H3
InChIKeyQKNNUDBEZSJPFE-UHFFFAOYSA-N
MW356.24 g/mol
LogP2.51
Rot. Bonds6

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

[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine (PubChem CID 105258683) has the molecular formula C14H19BrFN5 and a molecular weight of 356.24 g/mol. Its IUPAC name is [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
PubChem CID105258683
Molecular FormulaC14H19BrFN5
Molecular Weight356.24 g/mol
Exact Mass355.08
IUPAC Name[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
SMILESCCc1nn(CC)c(CC(NN)c2ccncc2F)c1Br
InChIInChI=1S/C14H19BrFN5/c1-3-11-14(15)13(21(4-2)20-11)7-12(19-17)9-5-6-18-8-10(9)16/h5-6,8,12,19H,3-4,7,17H2,1-2H3
InChIKeyQKNNUDBEZSJPFE-UHFFFAOYSA-N
XLogP2.51
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.24
LogP ≤ 52.51
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-(1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105258682
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-methyl-4-pyridinyl)ethyl]hydrazine
CID 106756613
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(6-methyl-3-pyridinyl)ethyl]hydrazine
CID 105318849
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(5-bromofuran-2-yl)ethyl]hydrazine
CID 105318898
[1-(4-bromo-1,3-diethylpyrazol-5-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
CID 105212505
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-methylphenyl)ethyl]hydrazine
CID 105200822
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(4-bromothiophen-2-yl)ethyl]hydrazine
CID 105222593
[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105258715
2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(5-fluoro-3-pyridinyl)-N-methylethanamine
CID 105162282
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262062
[1-(3-fluoro-4-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105258519
2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(2-chlorofuran-3-yl)-N-methylethanamine
CID 106692448

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine (CID 105258683) is [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine is CCc1nn(CC)c(CC(NN)c2ccncc2F)c1Br.
What is the InChIKey of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
The InChIKey is QKNNUDBEZSJPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrFN5/c1-3-11-14(15)13(21(4-2)20-11)7-12(19-17)9-5-6-18-8-10(9)16/h5-6,8,12,19H,3-4,7,17H2,1-2H3.
What are the key properties of [2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
[2-(4-bromo-1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine has a molecular weight of 356.24 g/mol, XLogP of 2.51, 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-(3-fluoro-4-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105258683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).