[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine

C13H15ClN4O — CID 103445839

IUPAC[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
SMILESCCOc1cncc(C(NN)c2ncccc2Cl)c1
InChIInChI=1S/C13H15ClN4O/c1-2-19-10-6-9(7-16-8-10)12(18-15)13-11(14)4-3-5-17-13/h3-8,12,18H,2,15H2,1H3
InChIKeyUKYUOZZUZNMSMJ-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.08
Rot. Bonds5

About [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine

[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 103445839) has the molecular formula C13H15ClN4O and a molecular weight of 278.74 g/mol. Its IUPAC name is [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
PubChem CID103445839
Molecular FormulaC13H15ClN4O
Molecular Weight278.74 g/mol
Exact Mass278.09
IUPAC Name[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
SMILESCCOc1cncc(C(NN)c2ncccc2Cl)c1
InChIInChI=1S/C13H15ClN4O/c1-2-19-10-6-9(7-16-8-10)12(18-15)13-11(14)4-3-5-17-13/h3-8,12,18H,2,15H2,1H3
InChIKeyUKYUOZZUZNMSMJ-UHFFFAOYSA-N
XLogP2.08
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.08
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-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine (CID 103445839) is [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine is CCOc1cncc(C(NN)c2ncccc2Cl)c1.
What is the InChIKey of [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is UKYUOZZUZNMSMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O/c1-2-19-10-6-9(7-16-8-10)12(18-15)13-11(14)4-3-5-17-13/h3-8,12,18H,2,15H2,1H3.
What are the key properties of [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 278.74 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 103445839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).