[5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine

C13H20ClN3O — CID 62887207

IUPAC[5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
SMILESCC1CCCC(OCc2nc(NN)ccc2Cl)C1
InChIInChI=1S/C13H20ClN3O/c1-9-3-2-4-10(7-9)18-8-12-11(14)5-6-13(16-12)17-15/h5-6,9-10H,2-4,7-8,15H2,1H3,(H,16,17)
InChIKeyRTKYVHFTUYQGJR-UHFFFAOYSA-N
MW269.78 g/mol
LogP3.12
Rot. Bonds4

About [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine

[5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine (PubChem CID 62887207) has the molecular formula C13H20ClN3O and a molecular weight of 269.78 g/mol. Its IUPAC name is [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
PubChem CID62887207
Molecular FormulaC13H20ClN3O
Molecular Weight269.78 g/mol
Exact Mass269.13
IUPAC Name[5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
SMILESCC1CCCC(OCc2nc(NN)ccc2Cl)C1
InChIInChI=1S/C13H20ClN3O/c1-9-3-2-4-10(7-9)18-8-12-11(14)5-6-13(16-12)17-15/h5-6,9-10H,2-4,7-8,15H2,1H3,(H,16,17)
InChIKeyRTKYVHFTUYQGJR-UHFFFAOYSA-N
XLogP3.12
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.78
LogP ≤ 53.12
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 [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
The IUPAC name of [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine (CID 62887207) is [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine is CC1CCCC(OCc2nc(NN)ccc2Cl)C1.
What is the InChIKey of [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
The InChIKey is RTKYVHFTUYQGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O/c1-9-3-2-4-10(7-9)18-8-12-11(14)5-6-13(16-12)17-15/h5-6,9-10H,2-4,7-8,15H2,1H3,(H,16,17).
What are the key properties of [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
[5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine has a molecular weight of 269.78 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-[(3-methylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 62887207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).