(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine

C10H13Cl2N3S — CID 102763301

IUPAC(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine
SMILESNNc1nc(SC2CCCC2)c(Cl)cc1Cl
InChIInChI=1S/C10H13Cl2N3S/c11-7-5-8(12)10(14-9(7)15-13)16-6-3-1-2-4-6/h5-6H,1-4,13H2,(H,14,15)
InChIKeyQBDLQTWHPIQMQM-UHFFFAOYSA-N
MW278.21 g/mol
LogP3.71
Rot. Bonds3

About (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine

(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine (PubChem CID 102763301) has the molecular formula C10H13Cl2N3S and a molecular weight of 278.21 g/mol. Its IUPAC name is (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine.

Molecular Properties

Compound Name(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine
PubChem CID102763301
Molecular FormulaC10H13Cl2N3S
Molecular Weight278.21 g/mol
Exact Mass277.02
IUPAC Name(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine
SMILESNNc1nc(SC2CCCC2)c(Cl)cc1Cl
InChIInChI=1S/C10H13Cl2N3S/c11-7-5-8(12)10(14-9(7)15-13)16-6-3-1-2-4-6/h5-6H,1-4,13H2,(H,14,15)
InChIKeyQBDLQTWHPIQMQM-UHFFFAOYSA-N
XLogP3.71
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.21
LogP ≤ 53.71
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 (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine?
The IUPAC name of (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine (CID 102763301) is (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine.
What is the SMILES notation for (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine?
The canonical SMILES for (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine is NNc1nc(SC2CCCC2)c(Cl)cc1Cl.
What is the InChIKey of (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine?
The InChIKey is QBDLQTWHPIQMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3S/c11-7-5-8(12)10(14-9(7)15-13)16-6-3-1-2-4-6/h5-6H,1-4,13H2,(H,14,15).
What are the key properties of (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine?
(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine has a molecular weight of 278.21 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine is sourced from PubChem (CID 102763301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).