[1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine

C15H21FN4 — CID 105302872

IUPAC[1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(Cc2c(C)nn(C)c2C)NN)c1
InChIInChI=1S/C15H21FN4/c1-9-5-6-14(16)13(7-9)15(18-17)8-12-10(2)19-20(4)11(12)3/h5-7,15,18H,8,17H2,1-4H3
InChIKeyKDGQKHVUDKNVKG-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.23
Rot. Bonds4

About [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine

[1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105302872) has the molecular formula C15H21FN4 and a molecular weight of 276.36 g/mol. Its IUPAC name is [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105302872
Molecular FormulaC15H21FN4
Molecular Weight276.36 g/mol
Exact Mass276.18
IUPAC Name[1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(Cc2c(C)nn(C)c2C)NN)c1
InChIInChI=1S/C15H21FN4/c1-9-5-6-14(16)13(7-9)15(18-17)8-12-10(2)19-20(4)11(12)3/h5-7,15,18H,8,17H2,1-4H3
InChIKeyKDGQKHVUDKNVKG-UHFFFAOYSA-N
XLogP2.23
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.23
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-(2,6-difluoro-3-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105330300
1-(2,5-difluorophenyl)-N-ethyl-2-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 105143859
[1-(5-fluoro-2-methoxyphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105330929
[1-(2-fluorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105292407
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105326726
[1-(4-fluoro-3-methylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105302658
[1-(3-methylthiophen-2-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105322494
[2-(2,5-dichlorophenyl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105309794
[2-(3-bromo-2,6-difluorophenyl)-1-(2-bromo-5-methylphenyl)ethyl]hydrazine
CID 106271871
[1-(2-fluoro-5-methylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105211767
[1-(2-chloro-6-fluorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-yl]hydrazine
CID 105289114
N-ethyl-1-(4-fluoro-2-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 105142748

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine (CID 105302872) is [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine is Cc1ccc(F)c(C(Cc2c(C)nn(C)c2C)NN)c1.
What is the InChIKey of [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is KDGQKHVUDKNVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN4/c1-9-5-6-14(16)13(7-9)15(18-17)8-12-10(2)19-20(4)11(12)3/h5-7,15,18H,8,17H2,1-4H3.
What are the key properties of [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
[1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 276.36 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-5-methylphenyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105302872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).