[(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine

C15H24N2S — CID 105255964

IUPAC[(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine
SMILESCC(C)c1ccc(C(NN)C2CCCCS2)cc1
InChIInChI=1S/C15H24N2S/c1-11(2)12-6-8-13(9-7-12)15(17-16)14-5-3-4-10-18-14/h6-9,11,14-15,17H,3-5,10,16H2,1-2H3
InChIKeySGDLSADBKXJRBF-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.60
Rot. Bonds4

About [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine

[(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine (PubChem CID 105255964) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine
PubChem CID105255964
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name[(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine
SMILESCC(C)c1ccc(C(NN)C2CCCCS2)cc1
InChIInChI=1S/C15H24N2S/c1-11(2)12-6-8-13(9-7-12)15(17-16)14-5-3-4-10-18-14/h6-9,11,14-15,17H,3-5,10,16H2,1-2H3
InChIKeySGDLSADBKXJRBF-UHFFFAOYSA-N
XLogP3.60
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.60
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-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255613
[(4-ethylphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255558
[(4-methoxyphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255443
[2-(4-propan-2-ylphenyl)-1-(thian-2-yl)ethyl]hydrazine
CID 105255638
[(4-chloro-3-methoxyphenyl)-(thian-2-yl)methyl]hydrazine
CID 105255698
[[3-(2-methylpropyl)phenyl]-(thian-2-yl)methyl]hydrazine
CID 105255948
[(1-methylpyrazol-4-yl)-(thian-2-yl)methyl]hydrazine
CID 105255705
[thian-2-yl-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105255884
2-(4-propan-2-ylphenyl)-1-(thian-2-yl)ethanol
CID 80621626
[(5-fluoro-2-methylphenyl)-(thian-2-yl)methyl]hydrazine
CID 105255690
[(3-fluoro-5-methylphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255608
[thian-2-yl-[3-(trifluoromethoxy)phenyl]methyl]hydrazine
CID 105255890

Frequently Asked Questions

What is the IUPAC name of [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine?
The IUPAC name of [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine (CID 105255964) is [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine is CC(C)c1ccc(C(NN)C2CCCCS2)cc1.
What is the InChIKey of [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine?
The InChIKey is SGDLSADBKXJRBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-11(2)12-6-8-13(9-7-12)15(17-16)14-5-3-4-10-18-14/h6-9,11,14-15,17H,3-5,10,16H2,1-2H3.
What are the key properties of [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine?
[(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine has a molecular weight of 264.44 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-propan-2-ylphenyl)-(thian-2-yl)methyl]hydrazine is sourced from PubChem (CID 105255964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).