[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine

C16H22N2S — CID 102843361

IUPAC[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCc1sccc1C(NN)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C16H22N2S/c1-11-14(9-10-19-11)15(18-17)12-5-7-13(8-6-12)16(2,3)4/h5-10,15,18H,17H2,1-4H3
InChIKeyYAJRLQVOIPBMSO-UHFFFAOYSA-N
MW274.43 g/mol
LogP3.91
Rot. Bonds3

About [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine

[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine (PubChem CID 102843361) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
PubChem CID102843361
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC Name[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCc1sccc1C(NN)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C16H22N2S/c1-11-14(9-10-19-11)15(18-17)12-5-7-13(8-6-12)16(2,3)4/h5-10,15,18H,17H2,1-4H3
InChIKeyYAJRLQVOIPBMSO-UHFFFAOYSA-N
XLogP3.91
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 53.91
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

1-(4-tert-butylphenyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102841861
[(4-tert-butylphenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105300421
[(3-chloro-4-methylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843250
[(3-chloro-4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102842754
[(2-methylthiophen-3-yl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 102842698
[(3-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102842614
[[2-fluoro-5-(trifluoromethyl)phenyl]-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102842935
[(2-bromo-3-methylphenyl)-(4-tert-butylphenyl)methyl]hydrazine
CID 107986010
N-[(2-methylthiophen-3-yl)-[4-(trifluoromethyl)phenyl]methyl]ethanamine
CID 102840771
[(3-methoxyphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102842607
[(4-tert-butylphenyl)-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105300389
[(2-methylfuran-3-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843049

Frequently Asked Questions

What is the IUPAC name of [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine (CID 102843361) is [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine is Cc1sccc1C(NN)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The InChIKey is YAJRLQVOIPBMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-11-14(9-10-19-11)15(18-17)12-5-7-13(8-6-12)16(2,3)4/h5-10,15,18H,17H2,1-4H3.
What are the key properties of [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
[(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine has a molecular weight of 274.43 g/mol, XLogP of 3.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 102843361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).