[(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine

C12H15N3S — CID 105287512

IUPAC[(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cccs2)c(C)n1
InChIInChI=1S/C12H15N3S/c1-8-5-6-10(9(2)14-8)12(15-13)11-4-3-7-16-11/h3-7,12,15H,13H2,1-2H3
InChIKeyPTYBMUQIMHAXBT-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.31
Rot. Bonds3

About [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine

[(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine (PubChem CID 105287512) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
PubChem CID105287512
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC Name[(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cccs2)c(C)n1
InChIInChI=1S/C12H15N3S/c1-8-5-6-10(9(2)14-8)12(15-13)11-4-3-7-16-11/h3-7,12,15H,13H2,1-2H3
InChIKeyPTYBMUQIMHAXBT-UHFFFAOYSA-N
XLogP2.31
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.31
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 [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine?
The IUPAC name of [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine (CID 105287512) is [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine.
What is the SMILES notation for [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine?
The canonical SMILES for [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine is Cc1ccc(C(NN)c2cccs2)c(C)n1.
What is the InChIKey of [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine?
The InChIKey is PTYBMUQIMHAXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c1-8-5-6-10(9(2)14-8)12(15-13)11-4-3-7-16-11/h3-7,12,15H,13H2,1-2H3.
What are the key properties of [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine?
[(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine has a molecular weight of 233.34 g/mol, XLogP of 2.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,6-dimethyl-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine is sourced from PubChem (CID 105287512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).