[1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine

C15H21FN4 — CID 105204664

IUPAC[1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine
SMILESCCn1nc(C)cc1CC(Cc1cccc(F)c1)NN
InChIInChI=1S/C15H21FN4/c1-3-20-15(7-11(2)19-20)10-14(18-17)9-12-5-4-6-13(16)8-12/h4-8,14,18H,3,9-10,17H2,1-2H3
InChIKeyZUCHQUDVOORLLT-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.97
Rot. Bonds6

About [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine

[1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine (PubChem CID 105204664) has the molecular formula C15H21FN4 and a molecular weight of 276.36 g/mol. Its IUPAC name is [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine
PubChem CID105204664
Molecular FormulaC15H21FN4
Molecular Weight276.36 g/mol
Exact Mass276.18
IUPAC Name[1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine
SMILESCCn1nc(C)cc1CC(Cc1cccc(F)c1)NN
InChIInChI=1S/C15H21FN4/c1-3-20-15(7-11(2)19-20)10-14(18-17)9-12-5-4-6-13(16)8-12/h4-8,14,18H,3,9-10,17H2,1-2H3
InChIKeyZUCHQUDVOORLLT-UHFFFAOYSA-N
XLogP1.97
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.97
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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Frequently Asked Questions

What is the IUPAC name of [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine (CID 105204664) is [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine is CCn1nc(C)cc1CC(Cc1cccc(F)c1)NN.
What is the InChIKey of [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine?
The InChIKey is ZUCHQUDVOORLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN4/c1-3-20-15(7-11(2)19-20)10-14(18-17)9-12-5-4-6-13(16)8-12/h4-8,14,18H,3,9-10,17H2,1-2H3.
What are the key properties of [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine?
[1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine has a molecular weight of 276.36 g/mol, XLogP of 1.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethyl-5-methylpyrazol-3-yl)-3-(3-fluorophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105204664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).