[1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine

C13H17ClN4 — CID 105329500

IUPAC[1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCc1cc(C(Cc2ccn(C)n2)NN)ccc1Cl
InChIInChI=1S/C13H17ClN4/c1-9-7-10(3-4-12(9)14)13(16-15)8-11-5-6-18(2)17-11/h3-7,13,16H,8,15H2,1-2H3
InChIKeyVIWUJWYYLTVMBB-UHFFFAOYSA-N
MW264.76 g/mol
LogP2.13
Rot. Bonds4

About [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine

[1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105329500) has the molecular formula C13H17ClN4 and a molecular weight of 264.76 g/mol. Its IUPAC name is [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105329500
Molecular FormulaC13H17ClN4
Molecular Weight264.76 g/mol
Exact Mass264.11
IUPAC Name[1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCc1cc(C(Cc2ccn(C)n2)NN)ccc1Cl
InChIInChI=1S/C13H17ClN4/c1-9-7-10(3-4-12(9)14)13(16-15)8-11-5-6-18(2)17-11/h3-7,13,16H,8,15H2,1-2H3
InChIKeyVIWUJWYYLTVMBB-UHFFFAOYSA-N
XLogP2.13
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.76
LogP ≤ 52.13
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-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329446
[1-(2,6-dimethyl-4-pyridinyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 107504950
[1-(5-chloro-2-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329657
[2-(1-methylpyrazol-3-yl)-1-phenylethyl]hydrazine
CID 105199243
1-(3,4-dichlorophenyl)-N-ethyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82877569
[1-(2,4-dichlorophenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329457
N-[1-(3-chloro-4-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 105025227
[2-(1-methylpyrazol-3-yl)-1-pyrimidin-5-ylethyl]hydrazine
CID 102924279
[2-(1-methylpyrazol-3-yl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105279805
[1-(2-chloro-4-fluorophenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105215355
[1-[3-(difluoromethoxy)phenyl]-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329486
[2-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105329598

Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine (CID 105329500) is [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine is Cc1cc(C(Cc2ccn(C)n2)NN)ccc1Cl.
What is the InChIKey of [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is VIWUJWYYLTVMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN4/c1-9-7-10(3-4-12(9)14)13(16-15)8-11-5-6-18(2)17-11/h3-7,13,16H,8,15H2,1-2H3.
What are the key properties of [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
[1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 264.76 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-3-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105329500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).