[3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine

C10H13Cl2N3OS — CID 102763303

IUPAC[3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine
SMILESNNc1nc(SC2CCOCC2)c(Cl)cc1Cl
InChIInChI=1S/C10H13Cl2N3OS/c11-7-5-8(12)10(14-9(7)15-13)17-6-1-3-16-4-2-6/h5-6H,1-4,13H2,(H,14,15)
InChIKeyDVDSLXDPSOYFLH-UHFFFAOYSA-N
MW294.21 g/mol
LogP2.95
Rot. Bonds3

About [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine

[3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine (PubChem CID 102763303) has the molecular formula C10H13Cl2N3OS and a molecular weight of 294.21 g/mol. Its IUPAC name is [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine
PubChem CID102763303
Molecular FormulaC10H13Cl2N3OS
Molecular Weight294.21 g/mol
Exact Mass293.02
IUPAC Name[3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine
SMILESNNc1nc(SC2CCOCC2)c(Cl)cc1Cl
InChIInChI=1S/C10H13Cl2N3OS/c11-7-5-8(12)10(14-9(7)15-13)17-6-1-3-16-4-2-6/h5-6H,1-4,13H2,(H,14,15)
InChIKeyDVDSLXDPSOYFLH-UHFFFAOYSA-N
XLogP2.95
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.21
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine?
The IUPAC name of [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine (CID 102763303) is [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine is NNc1nc(SC2CCOCC2)c(Cl)cc1Cl.
What is the InChIKey of [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine?
The InChIKey is DVDSLXDPSOYFLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3OS/c11-7-5-8(12)10(14-9(7)15-13)17-6-1-3-16-4-2-6/h5-6H,1-4,13H2,(H,14,15).
What are the key properties of [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine?
[3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine has a molecular weight of 294.21 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-6-(oxan-4-ylsulfanyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 102763303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).