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

C10H19ClN4S — CID 105227220

IUPAC[2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine
SMILESCCC(C)SCC(NN)c1c(Cl)cnn1C
InChIInChI=1S/C10H19ClN4S/c1-4-7(2)16-6-9(14-12)10-8(11)5-13-15(10)3/h5,7,9,14H,4,6,12H2,1-3H3
InChIKeyGUVCJBPJTVZUEO-UHFFFAOYSA-N
MW262.81 g/mol
LogP2.11
Rot. Bonds6

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

[2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine (PubChem CID 105227220) has the molecular formula C10H19ClN4S and a molecular weight of 262.81 g/mol. Its IUPAC name is [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine
PubChem CID105227220
Molecular FormulaC10H19ClN4S
Molecular Weight262.81 g/mol
Exact Mass262.10
IUPAC Name[2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine
SMILESCCC(C)SCC(NN)c1c(Cl)cnn1C
InChIInChI=1S/C10H19ClN4S/c1-4-7(2)16-6-9(14-12)10-8(11)5-13-15(10)3/h5,7,9,14H,4,6,12H2,1-3H3
InChIKeyGUVCJBPJTVZUEO-UHFFFAOYSA-N
XLogP2.11
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.81
LogP ≤ 52.11
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'}

Analyze [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-(2-butan-2-ylsulfanyl-1-hydrazinylethyl)-4-chloropyrazol-1-yl]-N,N-dimethylethanamine
CID 105227166
[1-(4-chloro-1-methylpyrazol-5-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105206072
1-(4-chloro-1-methylpyrazol-5-yl)but-3-enylhydrazine
CID 105269743
2-butan-2-ylsulfanyl-N-ethyl-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114654035
1-(4-chloro-1-methylpyrazol-5-yl)-N-propylpropan-1-amine
CID 114647778
1-(4-chloro-1-methylpyrazol-5-yl)-2-ethylsulfanylethanamine
CID 114653440
[1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine
CID 105338877
[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
CID 105271122
1-(4-chloro-1-methylpyrazol-5-yl)-3-methyl-N-propylpentan-1-amine
CID 105046660
[2-chloro-1-(4-chloro-1-methylpyrazol-5-yl)-2,2-difluoroethyl]hydrazine
CID 105265541
[2-butan-2-ylsulfanyl-1-(3-phenyltriazol-4-yl)ethyl]hydrazine
CID 105227341
1-(4-chloro-1-methylpyrazol-5-yl)-N-ethylhexan-1-amine
CID 105046403

Frequently Asked Questions

What is the IUPAC name of [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine (CID 105227220) is [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine is CCC(C)SCC(NN)c1c(Cl)cnn1C.
What is the InChIKey of [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine?
The InChIKey is GUVCJBPJTVZUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClN4S/c1-4-7(2)16-6-9(14-12)10-8(11)5-13-15(10)3/h5,7,9,14H,4,6,12H2,1-3H3.
What are the key properties of [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine?
[2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine has a molecular weight of 262.81 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-butan-2-ylsulfanyl-1-(4-chloro-1-methylpyrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105227220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).