[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine

C12H14Cl2N4 — CID 105289840

IUPAC[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
SMILESCCn1cc(C(NN)c2cc(Cl)cc(Cl)c2)cn1
InChIInChI=1S/C12H14Cl2N4/c1-2-18-7-9(6-16-18)12(17-15)8-3-10(13)5-11(14)4-8/h3-7,12,17H,2,15H2,1H3
InChIKeyYDGVYWRDLTWTAI-UHFFFAOYSA-N
MW285.18 g/mol
LogP2.76
Rot. Bonds4

About [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine

[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105289840) has the molecular formula C12H14Cl2N4 and a molecular weight of 285.18 g/mol. Its IUPAC name is [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
PubChem CID105289840
Molecular FormulaC12H14Cl2N4
Molecular Weight285.18 g/mol
Exact Mass284.06
IUPAC Name[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
SMILESCCn1cc(C(NN)c2cc(Cl)cc(Cl)c2)cn1
InChIInChI=1S/C12H14Cl2N4/c1-2-18-7-9(6-16-18)12(17-15)8-3-10(13)5-11(14)4-8/h3-7,12,17H,2,15H2,1H3
InChIKeyYDGVYWRDLTWTAI-UHFFFAOYSA-N
XLogP2.76
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.18
LogP ≤ 52.76
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

[(4-bromo-3-chlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289852
[(1-ethylpyrazol-4-yl)-(4-methylphenyl)methyl]hydrazine
CID 105194304
[(3,4-dimethylphenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289747
1-(3,5-dichlorophenyl)-N-methyl-1-(1-propylpyrazol-4-yl)methanamine
CID 115808123
[(3-bromophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105197955
[(1,5-dimethylpyrazol-4-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289841
[(1-ethylpyrazol-4-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 105191655
[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105222445
[(1-ethylpyrazol-4-yl)-(thiadiazol-4-yl)methyl]hydrazine
CID 105289774
[(1-ethylpyrazol-4-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105258084
[(1-ethylpyrazol-4-yl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228657
[(4-chloro-2-fluorophenyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105217842

Frequently Asked Questions

What is the IUPAC name of [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine (CID 105289840) is [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine is CCn1cc(C(NN)c2cc(Cl)cc(Cl)c2)cn1.
What is the InChIKey of [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is YDGVYWRDLTWTAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N4/c1-2-18-7-9(6-16-18)12(17-15)8-3-10(13)5-11(14)4-8/h3-7,12,17H,2,15H2,1H3.
What are the key properties of [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 285.18 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105289840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).