[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine

C18H24N2S — CID 105300389

IUPAC[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine
SMILESCSc1ccccc1C(NN)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H24N2S/c1-18(2,3)14-11-9-13(10-12-14)17(20-19)15-7-5-6-8-16(15)21-4/h5-12,17,20H,19H2,1-4H3
InChIKeySNGCHPGYLPVKCH-UHFFFAOYSA-N
MW300.47 g/mol
LogP4.26
Rot. Bonds4

About [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine

[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine (PubChem CID 105300389) has the molecular formula C18H24N2S and a molecular weight of 300.47 g/mol. Its IUPAC name is [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine
PubChem CID105300389
Molecular FormulaC18H24N2S
Molecular Weight300.47 g/mol
Exact Mass300.17
IUPAC Name[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine
SMILESCSc1ccccc1C(NN)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H24N2S/c1-18(2,3)14-11-9-13(10-12-14)17(20-19)15-7-5-6-8-16(15)21-4/h5-12,17,20H,19H2,1-4H3
InChIKeySNGCHPGYLPVKCH-UHFFFAOYSA-N
XLogP4.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.47
LogP ≤ 54.26
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

[(4-fluoro-3-methylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105302612
[(4-tert-butylphenyl)-(2-chloro-3-fluorophenyl)methyl]hydrazine
CID 105300390
[(2-bromo-3-methylphenyl)-(4-tert-butylphenyl)methyl]hydrazine
CID 107986010
[(2-methylsulfanylphenyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313270
[(5-fluoro-3-pyridinyl)-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105288108
[(2-tert-butylphenyl)-(4-chlorophenyl)methyl]hydrazine
CID 105281154
[(4-tert-butylphenyl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203825
[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843361
[(2-methylsulfanylphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105305698
[(2-methylsulfanylphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318725
[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190992
[(5-bromo-2-chlorophenyl)-(4-tert-butylphenyl)methyl]hydrazine
CID 105300354

Frequently Asked Questions

What is the IUPAC name of [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine (CID 105300389) is [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine is CSc1ccccc1C(NN)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine?
The InChIKey is SNGCHPGYLPVKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2S/c1-18(2,3)14-11-9-13(10-12-14)17(20-19)15-7-5-6-8-16(15)21-4/h5-12,17,20H,19H2,1-4H3.
What are the key properties of [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine?
[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine has a molecular weight of 300.47 g/mol, XLogP of 4.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine is sourced from PubChem (CID 105300389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).