[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine

C15H16Cl2N2S — CID 105293121

IUPAC[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
SMILESNNC(Cc1c(Cl)cccc1Cl)c1cc2c(s1)CCC2
InChIInChI=1S/C15H16Cl2N2S/c16-11-4-2-5-12(17)10(11)8-13(19-18)15-7-9-3-1-6-14(9)20-15/h2,4-5,7,13,19H,1,3,6,8,18H2
InChIKeyYHRSEOUAYZLBHL-UHFFFAOYSA-N
MW327.28 g/mol
LogP4.29
Rot. Bonds4

About [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine

[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine (PubChem CID 105293121) has the molecular formula C15H16Cl2N2S and a molecular weight of 327.28 g/mol. Its IUPAC name is [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
PubChem CID105293121
Molecular FormulaC15H16Cl2N2S
Molecular Weight327.28 g/mol
Exact Mass326.04
IUPAC Name[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
SMILESNNC(Cc1c(Cl)cccc1Cl)c1cc2c(s1)CCC2
InChIInChI=1S/C15H16Cl2N2S/c16-11-4-2-5-12(17)10(11)8-13(19-18)15-7-9-3-1-6-14(9)20-15/h2,4-5,7,13,19H,1,3,6,8,18H2
InChIKeyYHRSEOUAYZLBHL-UHFFFAOYSA-N
XLogP4.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.28
LogP ≤ 54.29
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 [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine (CID 105293121) is [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine is NNC(Cc1c(Cl)cccc1Cl)c1cc2c(s1)CCC2.
What is the InChIKey of [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The InChIKey is YHRSEOUAYZLBHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2S/c16-11-4-2-5-12(17)10(11)8-13(19-18)15-7-9-3-1-6-14(9)20-15/h2,4-5,7,13,19H,1,3,6,8,18H2.
What are the key properties of [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine has a molecular weight of 327.28 g/mol, XLogP of 4.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105293121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).