[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine

C12H19ClN6 — CID 105228301

IUPAC[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1nc(C)c(Cl)c1CC(NN)c1cnn(C)c1
InChIInChI=1S/C12H19ClN6/c1-4-19-11(12(13)8(2)17-19)5-10(16-14)9-6-15-18(3)7-9/h6-7,10,16H,4-5,14H2,1-3H3
InChIKeyHCVSFEBVFJZPJM-UHFFFAOYSA-N
MW282.78 g/mol
LogP1.35
Rot. Bonds5

About [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine

[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105228301) has the molecular formula C12H19ClN6 and a molecular weight of 282.78 g/mol. Its IUPAC name is [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105228301
Molecular FormulaC12H19ClN6
Molecular Weight282.78 g/mol
Exact Mass282.14
IUPAC Name[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1nc(C)c(Cl)c1CC(NN)c1cnn(C)c1
InChIInChI=1S/C12H19ClN6/c1-4-19-11(12(13)8(2)17-19)5-10(16-14)9-6-15-18(3)7-9/h6-7,10,16H,4-5,14H2,1-3H3
InChIKeyHCVSFEBVFJZPJM-UHFFFAOYSA-N
XLogP1.35
TPSA73.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.78
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105228327
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-pyridin-4-ylethyl]hydrazine
CID 105196368
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(4-methylsulfanylphenyl)ethyl]hydrazine
CID 105316992
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262062
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(3-methyl-2-pyridinyl)ethyl]hydrazine
CID 105209109
1,2-bis(1-methylpyrazol-4-yl)ethylhydrazine
CID 105228414
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(2,5-dibromophenyl)ethyl]hydrazine
CID 105316977
[1-(3-bromo-2-methylphenyl)-2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)ethyl]hydrazine
CID 105317005
[1-(2-bromo-5-methylphenyl)-2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)ethyl]hydrazine
CID 105317018
[1-(4-bromo-2-chlorophenyl)-2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)ethyl]hydrazine
CID 105317004
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(3-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105263692
[3-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1,1-difluoropropan-2-yl]hydrazine
CID 105264979

Frequently Asked Questions

What is the IUPAC name of [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine (CID 105228301) is [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine is CCn1nc(C)c(Cl)c1CC(NN)c1cnn(C)c1.
What is the InChIKey of [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is HCVSFEBVFJZPJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN6/c1-4-19-11(12(13)8(2)17-19)5-10(16-14)9-6-15-18(3)7-9/h6-7,10,16H,4-5,14H2,1-3H3.
What are the key properties of [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine?
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 282.78 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105228301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).