[1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine

C15H20ClFN4 — CID 105318291

IUPAC[1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine
SMILESCCc1cc(CC(NN)c2c(F)cccc2Cl)n(CC)n1
InChIInChI=1S/C15H20ClFN4/c1-3-10-8-11(21(4-2)20-10)9-14(19-18)15-12(16)6-5-7-13(15)17/h5-8,14,19H,3-4,9,18H2,1-2H3
InChIKeyAUUWHCIKHMPSQP-UHFFFAOYSA-N
MW310.80 g/mol
LogP3.01
Rot. Bonds6

About [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine

[1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine (PubChem CID 105318291) has the molecular formula C15H20ClFN4 and a molecular weight of 310.80 g/mol. Its IUPAC name is [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine
PubChem CID105318291
Molecular FormulaC15H20ClFN4
Molecular Weight310.80 g/mol
Exact Mass310.14
IUPAC Name[1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine
SMILESCCc1cc(CC(NN)c2c(F)cccc2Cl)n(CC)n1
InChIInChI=1S/C15H20ClFN4/c1-3-10-8-11(21(4-2)20-10)9-14(19-18)15-12(16)6-5-7-13(15)17/h5-8,14,19H,3-4,9,18H2,1-2H3
InChIKeyAUUWHCIKHMPSQP-UHFFFAOYSA-N
XLogP3.01
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.80
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)-N-methylethanamine
CID 105001764
[2-(1,3-diethylpyrazol-5-yl)-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 105318378
1-(2,6-dichlorophenyl)-2-(1,3-diethylpyrazol-5-yl)-N-methylethanamine
CID 105001665
[1-(3-chloro-4-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine
CID 105218225
[2-(1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105258682
[1-(1,3-diethylpyrazol-5-yl)-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105207014
[(1,3-diethylpyrazol-5-yl)-(2,6-difluorophenyl)methyl]hydrazine
CID 105308082
[1-(2-chloro-6-fluorophenyl)-2-(2,6-difluorophenyl)ethyl]hydrazine
CID 105342808
[2-(1,3-diethylpyrazol-5-yl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105279906
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(2-chloro-6-fluorophenyl)ethyl]hydrazine
CID 105314861
[2-(1,3-diethylpyrazol-5-yl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262256
[2-(1,3-diethylpyrazol-5-yl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
CID 105269153

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine (CID 105318291) is [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine is CCc1cc(CC(NN)c2c(F)cccc2Cl)n(CC)n1.
What is the InChIKey of [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine?
The InChIKey is AUUWHCIKHMPSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClFN4/c1-3-10-8-11(21(4-2)20-10)9-14(19-18)15-12(16)6-5-7-13(15)17/h5-8,14,19H,3-4,9,18H2,1-2H3.
What are the key properties of [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine?
[1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine has a molecular weight of 310.80 g/mol, XLogP of 3.01, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105318291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).