[2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine

C13H17N3S — CID 105196515

IUPAC[2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine
SMILESCCc1ccc(CC(NN)c2ccncc2)s1
InChIInChI=1S/C13H17N3S/c1-2-11-3-4-12(17-11)9-13(16-14)10-5-7-15-8-6-10/h3-8,13,16H,2,9,14H2,1H3
InChIKeyDVHWPTFLBDZJBC-UHFFFAOYSA-N
MW247.37 g/mol
LogP2.45
Rot. Bonds5

About [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine

[2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine (PubChem CID 105196515) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine
PubChem CID105196515
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC Name[2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine
SMILESCCc1ccc(CC(NN)c2ccncc2)s1
InChIInChI=1S/C13H17N3S/c1-2-11-3-4-12(17-11)9-13(16-14)10-5-7-15-8-6-10/h3-8,13,16H,2,9,14H2,1H3
InChIKeyDVHWPTFLBDZJBC-UHFFFAOYSA-N
XLogP2.45
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine?
The IUPAC name of [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine (CID 105196515) is [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine.
What is the SMILES notation for [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine?
The canonical SMILES for [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine is CCc1ccc(CC(NN)c2ccncc2)s1.
What is the InChIKey of [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine?
The InChIKey is DVHWPTFLBDZJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-2-11-3-4-12(17-11)9-13(16-14)10-5-7-15-8-6-10/h3-8,13,16H,2,9,14H2,1H3.
What are the key properties of [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine?
[2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine has a molecular weight of 247.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-ethylthiophen-2-yl)-1-pyridin-4-ylethyl]hydrazine is sourced from PubChem (CID 105196515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).