1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine

C14H24N2S — CID 105293687

IUPAC1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine
SMILESCCCCC(NN)c1cc2c(s1)CCCCC2
InChIInChI=1S/C14H24N2S/c1-2-3-8-12(16-15)14-10-11-7-5-4-6-9-13(11)17-14/h10,12,16H,2-9,15H2,1H3
InChIKeyRWAIFDXZEVABME-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.71
Rot. Bonds5

About 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine

1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine (PubChem CID 105293687) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine.

Molecular Properties

Compound Name1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine
PubChem CID105293687
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine
SMILESCCCCC(NN)c1cc2c(s1)CCCCC2
InChIInChI=1S/C14H24N2S/c1-2-3-8-12(16-15)14-10-11-7-5-4-6-9-13(11)17-14/h10,12,16H,2-9,15H2,1H3
InChIKeyRWAIFDXZEVABME-UHFFFAOYSA-N
XLogP3.71
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.71
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-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine?
The IUPAC name of 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine (CID 105293687) is 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine.
What is the SMILES notation for 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine?
The canonical SMILES for 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine is CCCCC(NN)c1cc2c(s1)CCCCC2.
What is the InChIKey of 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine?
The InChIKey is RWAIFDXZEVABME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-2-3-8-12(16-15)14-10-11-7-5-4-6-9-13(11)17-14/h10,12,16H,2-9,15H2,1H3.
What are the key properties of 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine?
1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine has a molecular weight of 252.43 g/mol, XLogP of 3.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)pentylhydrazine is sourced from PubChem (CID 105293687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).