[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine

C15H24N2S — CID 105326402

IUPAC[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine
SMILESCCc1cccc(C(CC2CCSCC2)NN)c1
InChIInChI=1S/C15H24N2S/c1-2-12-4-3-5-14(10-12)15(17-16)11-13-6-8-18-9-7-13/h3-5,10,13,15,17H,2,6-9,11,16H2,1H3
InChIKeyZAGSMZLGZCUGNC-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.29
Rot. Bonds5

About [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine

[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine (PubChem CID 105326402) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine
PubChem CID105326402
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine
SMILESCCc1cccc(C(CC2CCSCC2)NN)c1
InChIInChI=1S/C15H24N2S/c1-2-12-4-3-5-14(10-12)15(17-16)11-13-6-8-18-9-7-13/h3-5,10,13,15,17H,2,6-9,11,16H2,1H3
InChIKeyZAGSMZLGZCUGNC-UHFFFAOYSA-N
XLogP3.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.29
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

[2-cyclopropyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105253991
N-ethyl-1-(3-propylphenyl)-2-(thian-4-yl)ethanamine
CID 105188025
2-cycloheptyl-1-(3-ethylphenyl)-N-methylethanamine
CID 105018546
[2-cyclopropyl-1-(3-methylphenyl)ethyl]hydrazine
CID 105200606
[2-cyclopropyl-1-(4-ethylphenyl)ethyl]hydrazine
CID 105197252
[2-cyclopropyl-1-(3-ethylphenyl)propyl]hydrazine
CID 105326261
[1-(4-fluorophenyl)-2-(thian-4-yl)ethyl]hydrazine
CID 105284174
[(3-ethylphenyl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232166
[2-cyclopropyl-1-(3-methoxyphenyl)ethyl]hydrazine
CID 105191557
(R)-cyclopropyl-(3-ethylphenyl)methanamine
CID 55277646
(S)-cyclopropyl-(3-ethylphenyl)methanamine
CID 131196510
[2-cyclohexylsulfanyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105227705

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine (CID 105326402) is [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine is CCc1cccc(C(CC2CCSCC2)NN)c1.
What is the InChIKey of [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine?
The InChIKey is ZAGSMZLGZCUGNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-2-12-4-3-5-14(10-12)15(17-16)11-13-6-8-18-9-7-13/h3-5,10,13,15,17H,2,6-9,11,16H2,1H3.
What are the key properties of [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine?
[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine has a molecular weight of 264.44 g/mol, XLogP of 3.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105326402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).