[2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine

C13H16Cl2N4O — CID 114255685

IUPAC[2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCOc1cc(C(Cc2ccc(Cl)cc2Cl)NN)nn1C
InChIInChI=1S/C13H16Cl2N4O/c1-19-13(20-2)7-12(18-19)11(17-16)5-8-3-4-9(14)6-10(8)15/h3-4,6-7,11,17H,5,16H2,1-2H3
InChIKeyJQXPUOOJNKOIGA-UHFFFAOYSA-N
MW315.20 g/mol
LogP2.48
Rot. Bonds5

About [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine

[2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 114255685) has the molecular formula C13H16Cl2N4O and a molecular weight of 315.20 g/mol. Its IUPAC name is [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine
PubChem CID114255685
Molecular FormulaC13H16Cl2N4O
Molecular Weight315.20 g/mol
Exact Mass314.07
IUPAC Name[2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCOc1cc(C(Cc2ccc(Cl)cc2Cl)NN)nn1C
InChIInChI=1S/C13H16Cl2N4O/c1-19-13(20-2)7-12(18-19)11(17-16)5-8-3-4-9(14)6-10(8)15/h3-4,6-7,11,17H,5,16H2,1-2H3
InChIKeyJQXPUOOJNKOIGA-UHFFFAOYSA-N
XLogP2.48
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.20
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[2-(2-chlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine
CID 114255680
[2-(2,4-dichlorophenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
CID 105200066
[1-(5-chloro-2-methoxyphenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105200255
1,2-bis(2,4-dichlorophenyl)ethylhydrazine
CID 105295029
[1-(3-bromo-4-methoxyphenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105295115
[2-(2,4-dichlorophenyl)-1-phenylethyl]hydrazine
CID 105199352
[1-(4-bromo-1,3-dimethylpyrazol-5-yl)-3-(2,4-dichlorophenyl)propan-2-yl]hydrazine
CID 105200126
[2-(2,4-dichlorophenyl)-1-(furan-3-yl)ethyl]hydrazine
CID 105200228
[2-(2,4-dichlorophenyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105200174
[2-(2,4-dichlorophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
CID 105200111
[2-(2,4-dichlorophenyl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105200124
[1-(3,5-dibromophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 107978987

Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine (CID 114255685) is [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine is COc1cc(C(Cc2ccc(Cl)cc2Cl)NN)nn1C.
What is the InChIKey of [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is JQXPUOOJNKOIGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16Cl2N4O/c1-19-13(20-2)7-12(18-19)11(17-16)5-8-3-4-9(14)6-10(8)15/h3-4,6-7,11,17H,5,16H2,1-2H3.
What are the key properties of [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine?
[2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 315.20 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dichlorophenyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 114255685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).