[1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine

C12H22N2S — CID 105298469

IUPAC[1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine
SMILESCCc1ccc(C(CC(C)CC)NN)s1
InChIInChI=1S/C12H22N2S/c1-4-9(3)8-11(14-13)12-7-6-10(5-2)15-12/h6-7,9,11,14H,4-5,8,13H2,1-3H3
InChIKeyFNVKACMSTTUHOL-UHFFFAOYSA-N
MW226.39 g/mol
LogP3.25
Rot. Bonds6

About [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine

[1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine (PubChem CID 105298469) has the molecular formula C12H22N2S and a molecular weight of 226.39 g/mol. Its IUPAC name is [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine
PubChem CID105298469
Molecular FormulaC12H22N2S
Molecular Weight226.39 g/mol
Exact Mass226.15
IUPAC Name[1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine
SMILESCCc1ccc(C(CC(C)CC)NN)s1
InChIInChI=1S/C12H22N2S/c1-4-9(3)8-11(14-13)12-7-6-10(5-2)15-12/h6-7,9,11,14H,4-5,8,13H2,1-3H3
InChIKeyFNVKACMSTTUHOL-UHFFFAOYSA-N
XLogP3.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.39
LogP ≤ 53.25
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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Frequently Asked Questions

What is the IUPAC name of [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine?
The IUPAC name of [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine (CID 105298469) is [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine.
What is the SMILES notation for [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine?
The canonical SMILES for [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine is CCc1ccc(C(CC(C)CC)NN)s1.
What is the InChIKey of [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine?
The InChIKey is FNVKACMSTTUHOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2S/c1-4-9(3)8-11(14-13)12-7-6-10(5-2)15-12/h6-7,9,11,14H,4-5,8,13H2,1-3H3.
What are the key properties of [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine?
[1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine has a molecular weight of 226.39 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-ethylthiophen-2-yl)-3-methylpentyl]hydrazine is sourced from PubChem (CID 105298469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).