[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine

C11H15ClN2S — CID 105281249

IUPAC[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine
SMILESNNC(c1ccc(Cl)cc1)C1CCSC1
InChIInChI=1S/C11H15ClN2S/c12-10-3-1-8(2-4-10)11(14-13)9-5-6-15-7-9/h1-4,9,11,14H,5-7,13H2
InChIKeyWBHZLNAGICYHME-UHFFFAOYSA-N
MW242.77 g/mol
LogP2.60
Rot. Bonds3

About [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine

[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine (PubChem CID 105281249) has the molecular formula C11H15ClN2S and a molecular weight of 242.77 g/mol. Its IUPAC name is [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine
PubChem CID105281249
Molecular FormulaC11H15ClN2S
Molecular Weight242.77 g/mol
Exact Mass242.06
IUPAC Name[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine
SMILESNNC(c1ccc(Cl)cc1)C1CCSC1
InChIInChI=1S/C11H15ClN2S/c12-10-3-1-8(2-4-10)11(14-13)9-5-6-15-7-9/h1-4,9,11,14H,5-7,13H2
InChIKeyWBHZLNAGICYHME-UHFFFAOYSA-N
XLogP2.60
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.77
LogP ≤ 52.60
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-propylphenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105303906
[(4-chloro-3-methoxyphenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105320870
[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105301765
[(4-chlorophenyl)-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105193247
[quinolin-3-yl(thiolan-3-yl)methyl]hydrazine
CID 105286981
[(4-chlorophenyl)-(3-ethylcyclohexyl)methyl]hydrazine
CID 105193324
[2-(4-propan-2-ylphenyl)-1-(thiolan-3-yl)ethyl]hydrazine
CID 105297335
[cyclopropyl(phenyl)methyl]hydrazine
CID 53403097
[1-benzofuran-2-yl(thiolan-3-yl)methyl]hydrazine
CID 105337847
[2-(2,6-dichlorophenyl)-1-(thiolan-3-yl)ethyl]hydrazine
CID 105293205
[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine
CID 105327009
[(4-chlorophenyl)-(1,9-dioxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105193249

Frequently Asked Questions

What is the IUPAC name of [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
The IUPAC name of [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine (CID 105281249) is [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine is NNC(c1ccc(Cl)cc1)C1CCSC1.
What is the InChIKey of [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
The InChIKey is WBHZLNAGICYHME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2S/c12-10-3-1-8(2-4-10)11(14-13)9-5-6-15-7-9/h1-4,9,11,14H,5-7,13H2.
What are the key properties of [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine?
[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine has a molecular weight of 242.77 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105281249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).