[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine

C13H15Cl3N4 — CID 105337147

IUPAC[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine
SMILESCCCn1ncc(Cl)c1C(NN)c1cccc(Cl)c1Cl
InChIInChI=1S/C13H15Cl3N4/c1-2-6-20-13(10(15)7-18-20)12(19-17)8-4-3-5-9(14)11(8)16/h3-5,7,12,19H,2,6,17H2,1H3
InChIKeyCKCHRNDYCAWBIV-UHFFFAOYSA-N
MW333.65 g/mol
LogP3.81
Rot. Bonds5

About [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine

[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine (PubChem CID 105337147) has the molecular formula C13H15Cl3N4 and a molecular weight of 333.65 g/mol. Its IUPAC name is [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine
PubChem CID105337147
Molecular FormulaC13H15Cl3N4
Molecular Weight333.65 g/mol
Exact Mass332.04
IUPAC Name[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine
SMILESCCCn1ncc(Cl)c1C(NN)c1cccc(Cl)c1Cl
InChIInChI=1S/C13H15Cl3N4/c1-2-6-20-13(10(15)7-18-20)12(19-17)8-4-3-5-9(14)11(8)16/h3-5,7,12,19H,2,6,17H2,1H3
InChIKeyCKCHRNDYCAWBIV-UHFFFAOYSA-N
XLogP3.81
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.65
LogP ≤ 53.81
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

[(3-chloro-2-methylphenyl)-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 107103824
[(4-chloro-1-propylpyrazol-5-yl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194048
[(4-chloro-1-propylpyrazol-5-yl)-thiophen-2-ylmethyl]hydrazine
CID 105193576
[(2-chloro-4-methylphenyl)-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 106860223
[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-2-fluorophenyl)methyl]hydrazine
CID 105223487
N-[(2-chlorophenyl)-(4-chloro-1-propylpyrazol-5-yl)methyl]propan-1-amine
CID 114649324
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-1-(2,3-dichlorophenyl)-N-methylmethanamine
CID 105054587
[(2,3-dichlorophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105339380
[1-benzothiophen-3-yl-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105337177
2-[4-chloro-5-[(2-chlorophenyl)-hydrazinylmethyl]pyrazol-1-yl]-N,N-dimethylethanamine
CID 105211079
[(2-bromo-5-methylphenyl)-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105337238
[(3-bromo-2-chlorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105339857

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine (CID 105337147) is [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine is CCCn1ncc(Cl)c1C(NN)c1cccc(Cl)c1Cl.
What is the InChIKey of [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine?
The InChIKey is CKCHRNDYCAWBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl3N4/c1-2-6-20-13(10(15)7-18-20)12(19-17)8-4-3-5-9(14)11(8)16/h3-5,7,12,19H,2,6,17H2,1H3.
What are the key properties of [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine?
[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine has a molecular weight of 333.65 g/mol, XLogP of 3.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine is sourced from PubChem (CID 105337147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).