[2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine

C16H19ClN2S — CID 106868542

IUPAC[2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
SMILESCSc1ccccc1C(Cc1ccc(C)cc1Cl)NN
InChIInChI=1S/C16H19ClN2S/c1-11-7-8-12(14(17)9-11)10-15(19-18)13-5-3-4-6-16(13)20-2/h3-9,15,19H,10,18H2,1-2H3
InChIKeyHIPMKTOJMGZIRN-UHFFFAOYSA-N
MW306.86 g/mol
LogP4.12
Rot. Bonds5

About [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine

[2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine (PubChem CID 106868542) has the molecular formula C16H19ClN2S and a molecular weight of 306.86 g/mol. Its IUPAC name is [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
PubChem CID106868542
Molecular FormulaC16H19ClN2S
Molecular Weight306.86 g/mol
Exact Mass306.10
IUPAC Name[2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
SMILESCSc1ccccc1C(Cc1ccc(C)cc1Cl)NN
InChIInChI=1S/C16H19ClN2S/c1-11-7-8-12(14(17)9-11)10-15(19-18)13-5-3-4-6-16(13)20-2/h3-9,15,19H,10,18H2,1-2H3
InChIKeyHIPMKTOJMGZIRN-UHFFFAOYSA-N
XLogP4.12
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.86
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-chloro-4-methylphenyl)-N-ethyl-1-(2-methylsulfanylphenyl)ethanamine
CID 106866868
2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethanol
CID 106868019
[1-(4-chloro-2-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868423
[1-(5-bromo-2-methylphenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868638
[2-(4-bromo-2-chlorophenyl)-1-(2-bromo-4-methylphenyl)ethyl]hydrazine
CID 105335180
[1-(4-bromo-2,6-difluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868756
[1-(2-bromo-5-methylphenyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 105286618
[2-(2-chloro-4-methylphenyl)-1-(1,5-dimethylpyrazol-4-yl)ethyl]hydrazine
CID 106868341
[2-(2-chloro-4-methylphenyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 106868302
[2-(4-bromo-2-chlorophenyl)-1-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 105223390
[1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868426
[1-(2-chloro-4-methylphenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 106859721

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine (CID 106868542) is [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine is CSc1ccccc1C(Cc1ccc(C)cc1Cl)NN.
What is the InChIKey of [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
The InChIKey is HIPMKTOJMGZIRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2S/c1-11-7-8-12(14(17)9-11)10-15(19-18)13-5-3-4-6-16(13)20-2/h3-9,15,19H,10,18H2,1-2H3.
What are the key properties of [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
[2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine has a molecular weight of 306.86 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-4-methylphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine is sourced from PubChem (CID 106868542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).