[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine

C16H22N2S — CID 105292889

IUPAC[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine
SMILESCCc1ccc(C(CCCc2cccs2)NN)cc1
InChIInChI=1S/C16H22N2S/c1-2-13-8-10-14(11-9-13)16(18-17)7-3-5-15-6-4-12-19-15/h4,6,8-12,16,18H,2-3,5,7,17H2,1H3
InChIKeyIGKSGWCPHPOTJB-UHFFFAOYSA-N
MW274.43 g/mol
LogP3.84
Rot. Bonds7

About [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine

[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine (PubChem CID 105292889) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine
PubChem CID105292889
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC Name[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine
SMILESCCc1ccc(C(CCCc2cccs2)NN)cc1
InChIInChI=1S/C16H22N2S/c1-2-13-8-10-14(11-9-13)16(18-17)7-3-5-15-6-4-12-19-15/h4,6,8-12,16,18H,2-3,5,7,17H2,1H3
InChIKeyIGKSGWCPHPOTJB-UHFFFAOYSA-N
XLogP3.84
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 53.84
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-(furan-3-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 105305888
1-(4-ethylphenyl)decylhydrazine
CID 105197366
1-(4-propylphenyl)-4-thiophen-2-ylbutan-1-amine
CID 105144372
(2-methyl-6-thiophen-2-ylhexan-3-yl)hydrazine
CID 105281740
1-thiophen-2-yltetradecan-4-ylhydrazine
CID 105298385
1-(4-methoxyphenyl)-N-methyl-4-thiophen-2-ylbutan-1-amine
CID 105095361
[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine
CID 106650086
[1-(1-methylpyrazol-3-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 103141110
[1-(3-methyltriazol-4-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 105337635
[2-(4-ethylphenyl)-1-thiophen-2-ylethyl]hydrazine
CID 105193509
(1R)-1-(4-ethylphenyl)-N-methyl-N-(thiophen-2-ylmethyl)ethanamine
CID 70906118
[1-(3-chloro-4-methylphenyl)-3-thiophen-2-ylpropyl]hydrazine
CID 105308904

Frequently Asked Questions

What is the IUPAC name of [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine?
The IUPAC name of [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine (CID 105292889) is [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine.
What is the SMILES notation for [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine?
The canonical SMILES for [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine is CCc1ccc(C(CCCc2cccs2)NN)cc1.
What is the InChIKey of [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine?
The InChIKey is IGKSGWCPHPOTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-2-13-8-10-14(11-9-13)16(18-17)7-3-5-15-6-4-12-19-15/h4,6,8-12,16,18H,2-3,5,7,17H2,1H3.
What are the key properties of [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine?
[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine has a molecular weight of 274.43 g/mol, XLogP of 3.84, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine is sourced from PubChem (CID 105292889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).