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

C14H22N2S — CID 105255613

IUPAC[(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine
SMILESCC(C)c1ccc(C(NN)C2CCCS2)cc1
InChIInChI=1S/C14H22N2S/c1-10(2)11-5-7-12(8-6-11)14(16-15)13-4-3-9-17-13/h5-8,10,13-14,16H,3-4,9,15H2,1-2H3
InChIKeyFVGWDKNZBRMADF-UHFFFAOYSA-N
MW250.41 g/mol
LogP3.21
Rot. Bonds4

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

[(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine (PubChem CID 105255613) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine
PubChem CID105255613
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Name[(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine
SMILESCC(C)c1ccc(C(NN)C2CCCS2)cc1
InChIInChI=1S/C14H22N2S/c1-10(2)11-5-7-12(8-6-11)14(16-15)13-4-3-9-17-13/h5-8,10,13-14,16H,3-4,9,15H2,1-2H3
InChIKeyFVGWDKNZBRMADF-UHFFFAOYSA-N
XLogP3.21
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 53.21
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)-(thian-2-yl)methyl]hydrazine
CID 105255964
[(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
[(3-fluoro-5-methylphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255608
[(4-chloro-3-methoxyphenyl)-(thian-2-yl)methyl]hydrazine
CID 105255698
[[4-fluoro-3-(trifluoromethyl)phenyl]-(thiolan-2-yl)methyl]hydrazine
CID 107292378
[[3-(2-methylpropyl)phenyl]-(thian-2-yl)methyl]hydrazine
CID 105255948
[(2-propan-2-yloxyphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255493
[(2,4-dimethylphenyl)-(thiolan-2-yl)methyl]hydrazine
CID 105255377
1-(thiolan-2-yl)ethylhydrazine
CID 105255514
[(1-methylpyrazol-4-yl)-(thian-2-yl)methyl]hydrazine
CID 105255705

Frequently Asked Questions

What is the IUPAC name of [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine?
The IUPAC name of [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine (CID 105255613) is [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine is CC(C)c1ccc(C(NN)C2CCCS2)cc1.
What is the InChIKey of [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine?
The InChIKey is FVGWDKNZBRMADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2S/c1-10(2)11-5-7-12(8-6-11)14(16-15)13-4-3-9-17-13/h5-8,10,13-14,16H,3-4,9,15H2,1-2H3.
What are the key properties of [(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine?
[(4-propan-2-ylphenyl)-(thiolan-2-yl)methyl]hydrazine has a molecular weight of 250.41 g/mol, XLogP of 3.21, 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)-(thiolan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105255613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).