[3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine

C12H17Cl2N3O2 — CID 102763031

IUPAC[3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine
SMILESCOC1CCCC(Oc2nc(NN)c(Cl)cc2Cl)C1
InChIInChI=1S/C12H17Cl2N3O2/c1-18-7-3-2-4-8(5-7)19-12-10(14)6-9(13)11(16-12)17-15/h6-8H,2-5,15H2,1H3,(H,16,17)
InChIKeyIAMUGSLOWHWMQG-UHFFFAOYSA-N
MW306.19 g/mol
LogP3.01
Rot. Bonds4

About [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine

[3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine (PubChem CID 102763031) has the molecular formula C12H17Cl2N3O2 and a molecular weight of 306.19 g/mol. Its IUPAC name is [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine
PubChem CID102763031
Molecular FormulaC12H17Cl2N3O2
Molecular Weight306.19 g/mol
Exact Mass305.07
IUPAC Name[3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine
SMILESCOC1CCCC(Oc2nc(NN)c(Cl)cc2Cl)C1
InChIInChI=1S/C12H17Cl2N3O2/c1-18-7-3-2-4-8(5-7)19-12-10(14)6-9(13)11(16-12)17-15/h6-8H,2-5,15H2,1H3,(H,16,17)
InChIKeyIAMUGSLOWHWMQG-UHFFFAOYSA-N
XLogP3.01
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.19
LogP ≤ 53.01
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-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine?
The IUPAC name of [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine (CID 102763031) is [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine.
What is the SMILES notation for [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine?
The canonical SMILES for [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine is COC1CCCC(Oc2nc(NN)c(Cl)cc2Cl)C1.
What is the InChIKey of [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine?
The InChIKey is IAMUGSLOWHWMQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17Cl2N3O2/c1-18-7-3-2-4-8(5-7)19-12-10(14)6-9(13)11(16-12)17-15/h6-8H,2-5,15H2,1H3,(H,16,17).
What are the key properties of [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine?
[3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine has a molecular weight of 306.19 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-6-(3-methoxycyclohexyl)oxy-2-pyridinyl]hydrazine is sourced from PubChem (CID 102763031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).