[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine

C13H16Cl2N4 — CID 105291296

IUPAC[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1cc(CC(NN)c2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C13H16Cl2N4/c1-2-19-8-9(7-17-19)5-13(18-16)11-4-3-10(14)6-12(11)15/h3-4,6-8,13,18H,2,5,16H2,1H3
InChIKeyNGUFOCCFVPQMPM-UHFFFAOYSA-N
MW299.21 g/mol
LogP2.96
Rot. Bonds5

About [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine

[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105291296) has the molecular formula C13H16Cl2N4 and a molecular weight of 299.21 g/mol. Its IUPAC name is [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105291296
Molecular FormulaC13H16Cl2N4
Molecular Weight299.21 g/mol
Exact Mass298.08
IUPAC Name[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1cc(CC(NN)c2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C13H16Cl2N4/c1-2-19-8-9(7-17-19)5-13(18-16)11-4-3-10(14)6-12(11)15/h3-4,6-8,13,18H,2,5,16H2,1H3
InChIKeyNGUFOCCFVPQMPM-UHFFFAOYSA-N
XLogP2.96
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.21
LogP ≤ 52.96
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-(4-bromo-2-chlorophenyl)-2-(1-ethylpyrazol-4-yl)-N-methylethanamine
CID 115822078
N-[1-(4-bromo-2-chlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 115822076
1-(4-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethylpyrazol-4-yl)ethanamine
CID 115822270
[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291385
[1-(2-chloro-4-pyridinyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105252663
[1-(2,3-dimethylphenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291272
[1-(2,4-dichlorophenyl)-2-(furan-3-yl)ethyl]hydrazine
CID 105331708
[1-(2,4-dichlorophenyl)-2-(3,5-difluorophenyl)ethyl]hydrazine
CID 105413072
[1-(2,4-dichlorophenyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
CID 107066602
1,2-bis(2,4-dichlorophenyl)ethylhydrazine
CID 105295029
[2-(4-chloro-3-fluorophenyl)-1-(2,4-dichlorophenyl)ethyl]hydrazine
CID 107895525
[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291375

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine (CID 105291296) is [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine is CCn1cc(CC(NN)c2ccc(Cl)cc2Cl)cn1.
What is the InChIKey of [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is NGUFOCCFVPQMPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16Cl2N4/c1-2-19-8-9(7-17-19)5-13(18-16)11-4-3-10(14)6-12(11)15/h3-4,6-8,13,18H,2,5,16H2,1H3.
What are the key properties of [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 299.21 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105291296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).