[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine

C12H19N3O — CID 105272724

IUPAC[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
SMILESCOC(C1CC1)C(NN)c1cncc(C)c1
InChIInChI=1S/C12H19N3O/c1-8-5-10(7-14-6-8)11(15-13)12(16-2)9-3-4-9/h5-7,9,11-12,15H,3-4,13H2,1-2H3
InChIKeyXNKZQRRCANIUQT-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.32
Rot. Bonds5

About [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine

[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine (PubChem CID 105272724) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
PubChem CID105272724
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
SMILESCOC(C1CC1)C(NN)c1cncc(C)c1
InChIInChI=1S/C12H19N3O/c1-8-5-10(7-14-6-8)11(15-13)12(16-2)9-3-4-9/h5-7,9,11-12,15H,3-4,13H2,1-2H3
InChIKeyXNKZQRRCANIUQT-UHFFFAOYSA-N
XLogP1.32
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.32
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 [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine (CID 105272724) is [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine is COC(C1CC1)C(NN)c1cncc(C)c1.
What is the InChIKey of [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
The InChIKey is XNKZQRRCANIUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8-5-10(7-14-6-8)11(15-13)12(16-2)9-3-4-9/h5-7,9,11-12,15H,3-4,13H2,1-2H3.
What are the key properties of [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine?
[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine has a molecular weight of 221.30 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105272724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).